data_1zda_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 1zda _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 34.7 mt-30 . . . . . 0 N--CA 1.453 -0.297 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -151.08 -49.03 0.12 Allowed 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 125.221 1.408 . . . . 0.0 110.28 178.869 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 15.6 tpt180 -58.85 -36.91 75.35 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 123.124 0.57 . . . . 0.0 111.376 176.516 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -62.13 -49.28 76.51 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 123.065 0.546 . . . . 0.0 110.289 -179.685 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 85.8 m-85 -60.24 -46.09 90.99 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 123.263 0.625 . . . . 0.0 110.991 177.565 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 46.9 t80 -54.96 -48.3 73.37 Favored 'General case' 0 C--N 1.341 0.197 0 C-N-CA 122.934 0.494 . . . . 0.0 110.699 175.475 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -63.48 -46.66 85.17 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 122.709 0.404 . . . . 0.0 110.553 -176.598 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.04 -39.81 95.85 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 124.002 0.921 . . . . 0.0 111.824 178.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 66.9 tp -69.02 -48.6 62.56 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 123.515 0.726 . . . . 0.0 110.238 179.148 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 17.3 m-70 -81.84 61.77 5.34 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.292 1.037 . . . . 0.0 109.164 177.631 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 62.1 t0 -146.63 82.62 8.65 Favored Pre-proline 0 CA--C 1.533 0.319 0 C-N-CA 124.886 1.274 . . . . 0.0 108.022 179.33 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -69.09 -25.18 31.94 Favored 'Trans proline' 0 N--CA 1.455 -0.748 0 C-N-CA 123.093 2.529 . . . . 0.0 112.082 -177.346 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 17.8 m-80 -54.28 -48.97 70.65 Favored 'General case' 0 C--N 1.342 0.246 0 C-N-CA 124.248 1.019 . . . . 0.0 109.937 177.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -72.24 118.71 15.46 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 107.145 -1.428 . . . . 0.0 107.145 170.124 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 7.0 p-10 -66.68 160.37 25.72 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 123.504 0.722 . . . . 0.0 110.475 178.016 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -75.18 72.6 2.28 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.103 0.961 . . . . 0.0 111.115 -175.252 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.3 tp10 -171.62 -51.22 0.02 OUTLIER 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 127.139 2.175 . . . . 0.0 106.992 175.344 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 36.1 mm-40 -71.15 -45.48 63.45 Favored 'General case' 0 CA--C 1.53 0.184 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 170.51 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 27.6 ttm180 -52.46 -49.12 65.3 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 124.645 1.178 . . . . 0.0 109.926 170.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 50.7 t30 -61.42 -42.31 98.54 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.557 0.743 . . . . 0.0 110.783 178.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.67 -40.76 88.83 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 122.883 0.473 . . . . 0.0 111.425 177.218 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 62.6 mtpt -59.22 -47.33 85.75 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 118.375 0.534 . . . . 0.0 110.722 175.478 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 33.1 mm -56.78 -53.21 44.94 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.267 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 176.258 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 58.9 mttp -79.3 55.01 1.8 Allowed 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 125.308 1.443 . . . . 0.0 110.376 177.526 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 44.5 t -165.98 -48.63 0.03 OUTLIER 'General case' 0 N--CA 1.456 -0.155 0 C-N-CA 125.625 1.57 . . . . 0.0 108.178 -179.56 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 72.2 mt -54.79 -43.57 67.7 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 171.273 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 13.3 ptp180 -73.33 -49.38 27.74 Favored 'General case' 0 C--N 1.342 0.277 0 CA-C-N 117.982 0.355 . . . . 0.0 111.411 171.243 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 28.2 t70 . . . . . 0 N--CA 1.454 -0.237 0 C-N-CA 124.016 0.926 . . . . 0.0 110.002 -173.616 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 37.0 tt0 . . . . . 0 N--CA 1.452 -0.339 0 N-CA-C 111.605 0.224 . . . . 0.0 111.605 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 -57.61 -42.29 82.97 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 123.403 0.681 . . . . 0.0 110.173 172.76 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 6.4 mmp_? -65.91 -32.19 73.55 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-O 118.834 -0.603 . . . . 0.0 112.16 175.267 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 16.7 mmm180 -65.1 -47.59 76.65 Favored 'General case' 0 C--N 1.341 0.232 0 CA-C-N 119.09 0.859 . . . . 0.0 110.836 175.606 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 47.7 m-85 -59.4 -56.11 26.21 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 122.668 0.387 . . . . 0.0 110.751 175.575 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 70.8 t80 -48.03 -52.28 20.66 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 125.626 1.57 . . . . 0.0 110.8 179.138 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 4.4 tm-20 -53.57 -57.9 9.1 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.826 1.25 . . . . 0.0 110.409 175.91 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -53.49 -44.04 68.7 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 124.006 0.922 . . . . 0.0 112.435 -177.866 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 7.1 mp -61.35 -54.32 45.28 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 124.102 0.961 . . . . 0.0 111.283 179.519 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 32.5 m-70 -76.55 -48.14 20.32 Favored 'General case' 0 N--CA 1.457 -0.124 0 N-CA-C 113.046 0.758 . . . . 0.0 113.046 -169.908 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -54.78 113.92 6.1 Favored Pre-proline 0 CA--C 1.535 0.392 0 C-N-CA 124.238 1.015 . . . . 0.0 111.709 -174.288 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -54.95 -40.87 83.59 Favored 'Trans proline' 0 C--N 1.348 0.525 0 C-N-CA 123.481 2.787 . . . . 0.0 112.177 174.34 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 5.0 p30 -57.08 -36.36 70.48 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 123.95 0.9 . . . . 0.0 111.443 177.688 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -80.09 70.74 6.75 Favored 'General case' 0 C--N 1.343 0.31 0 N-CA-C 106.723 -1.584 . . . . 0.0 106.723 169.305 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 8.5 p30 -65.95 168.53 8.0 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 125.208 1.403 . . . . 0.0 110.368 177.415 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -34.59 -64.01 0.27 Allowed 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 126.108 1.763 . . . . 0.0 114.38 -169.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -60.6 -38.64 85.33 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 -176.736 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 25.4 mm100 -70.24 -41.26 73.79 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 123.43 0.692 . . . . 0.0 110.807 179.421 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 64.4 ttp85 -60.47 -45.52 93.43 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 124.388 1.075 . . . . 0.0 110.09 175.538 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 4.6 m-80 -62.06 -40.2 94.98 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 122.885 0.474 . . . . 0.0 110.796 175.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -62.04 -44.16 97.29 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 118.228 0.467 . . . . 0.0 111.349 176.292 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 10.5 mmmm -57.15 -55.87 29.1 Favored 'General case' 0 C--N 1.342 0.273 0 C-N-CA 123.074 0.549 . . . . 0.0 109.909 174.401 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 75.2 mt -52.66 -48.84 47.75 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.298 0 C-N-CA 123.714 0.806 . . . . 0.0 110.837 -179.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 66.5 tttm -60.99 -49.86 75.72 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 123.925 0.89 . . . . 0.0 111.296 -178.728 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 78.6 p -64.77 -41.04 96.18 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 123.2 0.6 . . . . 0.0 111.741 -178.328 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 72.4 mt -59.47 -45.1 94.01 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 C-N-CA 123.543 0.737 . . . . 0.0 109.326 173.48 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 54.0 ttp180 -78.23 58.82 2.14 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 125.139 1.376 . . . . 0.0 109.839 176.813 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 27.7 t70 . . . . . 0 N--CA 1.455 -0.214 0 C-N-CA 124.237 1.015 . . . . 0.0 110.439 179.645 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 . . . . . 0 N--CA 1.45 -0.439 0 N-CA-C 108.032 -1.099 . . . . 0.0 108.032 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 15.3 tp60 -154.45 -58.86 0.11 Allowed 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 108.075 -1.083 . . . . 0.0 108.075 179.457 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 3.4 tpm_? -60.66 -45.31 94.6 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 170.105 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 94.8 mtt-85 -54.8 -52.24 63.26 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 124.745 1.218 . . . . 0.0 110.639 177.129 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 21.1 m-85 -59.2 -44.03 92.24 Favored 'General case' 0 C--N 1.34 0.183 0 CA-C-O 119.085 -0.483 . . . . 0.0 111.426 177.789 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 49.3 t80 -59.66 -51.62 69.0 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 118.468 0.576 . . . . 0.0 110.578 178.797 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -55.89 -42.83 76.54 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 123.563 0.745 . . . . 0.0 110.998 179.409 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.77 -57.52 9.69 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.268 0.627 . . . . 0.0 111.576 178.512 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 72.6 mt -60.08 -53.64 55.35 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 124.467 1.107 . . . . 0.0 111.401 -176.481 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 36.6 m-70 -82.64 64.35 7.23 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.156 0.982 . . . . 0.0 109.217 -177.148 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 36.9 t0 -134.32 87.18 33.77 Favored Pre-proline 0 CA--C 1.533 0.301 0 C-N-CA 125.31 1.444 . . . . 0.0 107.949 179.77 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 96.1 Cg_exo -48.01 -43.59 29.89 Favored 'Trans proline' 0 N--CA 1.459 -0.555 0 C-N-CA 124.757 3.638 . . . . 0.0 113.885 -179.12 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 20.3 m120 -60.47 -48.84 80.0 Favored 'General case' 0 CA--C 1.529 0.141 0 C-N-CA 124.04 0.936 . . . . 0.0 111.442 -176.897 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 10.4 mp -75.57 133.28 40.99 Favored 'General case' 0 N--CA 1.456 -0.172 0 C-N-CA 122.938 0.495 . . . . 0.0 109.961 -179.162 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 20.5 p30 -79.41 177.26 8.99 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.517 0.727 . . . . 0.0 111.047 178.414 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -51.55 -48.4 63.09 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 124.432 1.093 . . . . 0.0 112.271 -178.026 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 13.8 tp10 -64.86 -42.87 94.5 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 122.933 0.493 . . . . 0.0 111.173 -178.078 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 65.9 mt-30 -62.36 -41.76 98.86 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 122.863 0.465 . . . . 0.0 110.837 177.735 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 95.5 mtt180 -60.3 -50.73 72.49 Favored 'General case' 0 C--O 1.225 -0.192 0 C-N-CA 122.887 0.475 . . . . 0.0 109.897 174.529 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 78.9 m-20 -53.25 -45.13 68.67 Favored 'General case' 0 C--N 1.341 0.208 0 C-N-CA 123.598 0.759 . . . . 0.0 111.088 178.216 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.75 -43.31 90.25 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 123.559 0.743 . . . . 0.0 111.108 176.734 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 79.2 mttt -59.36 -49.77 76.53 Favored 'General case' 0 C--N 1.341 0.235 0 CA-C-O 118.231 -0.89 . . . . 0.0 111.077 173.359 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 8.3 mm -56.73 -47.58 82.34 Favored 'Isoleucine or valine' 0 C--N 1.343 0.303 0 CA-C-N 119.418 1.008 . . . . 0.0 109.738 -178.337 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 27.3 ttpp -56.63 -45.74 81.37 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.255 1.022 . . . . 0.0 111.63 177.876 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 23.1 t -62.3 -47.44 84.28 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 123.298 0.639 . . . . 0.0 111.009 178.703 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 60.3 mt -60.82 -38.31 78.67 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 C-N-CA 125.005 1.322 . . . . 0.0 110.158 178.72 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 2.4 mmp_? -65.45 -1.04 2.21 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 124.999 1.319 . . . . 0.0 114.345 178.241 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 28.2 t70 . . . . . 0 CA--C 1.534 0.345 0 C-N-CA 123.458 0.703 . . . . 0.0 111.518 173.178 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 35.8 mt-30 . . . . . 0 CA--C 1.534 0.338 0 CA-C-O 118.899 -0.572 . . . . 0.0 111.55 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 20.8 tm0? -53.72 -36.97 62.84 Favored 'General case' 0 C--N 1.343 0.314 0 C-N-CA 124.46 1.104 . . . . 0.0 110.131 174.795 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 3.3 mpt_? -63.35 -54.91 29.45 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 123.897 0.879 . . . . 0.0 109.739 179.334 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 19.7 mmm180 -58.58 -47.92 82.67 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 124.04 0.936 . . . . 0.0 110.284 -178.257 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 26.8 t80 -54.55 -48.76 71.65 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 127.367 2.267 . . . . 0.0 111.646 175.874 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 79.7 t80 -65.0 -45.2 86.57 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 124.886 1.274 . . . . 0.0 110.967 -179.573 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -56.46 -51.95 66.51 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.339 0.656 . . . . 0.0 110.081 174.661 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.05 -41.44 87.9 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 124.102 0.961 . . . . 0.0 111.68 179.413 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 49.9 tp -58.56 -46.1 87.58 Favored 'General case' 0 C--N 1.339 0.14 0 C-N-CA 123.759 0.823 . . . . 0.0 110.137 177.643 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 23.0 m-70 -96.67 55.08 1.37 Allowed 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 123.981 0.912 . . . . 0.0 110.148 -178.415 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -142.28 89.17 8.67 Favored Pre-proline 0 CA--C 1.533 0.302 0 C-N-CA 123.816 0.846 . . . . 0.0 109.656 179.346 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_exo -53.48 -30.2 52.8 Favored 'Trans proline' 0 N--CA 1.458 -0.56 0 C-N-CA 124.397 3.398 . . . . 0.0 113.84 175.846 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 11.9 m120 -52.81 -47.71 67.45 Favored 'General case' 0 C--N 1.343 0.316 0 C-N-CA 124.294 1.038 . . . . 0.0 110.707 179.52 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 46.4 mt -69.14 118.45 12.05 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 107.061 -1.459 . . . . 0.0 107.061 169.555 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 12.7 p30 -61.75 156.57 19.99 Favored 'General case' 0 CA--C 1.529 0.155 0 C-N-CA 123.193 0.597 . . . . 0.0 110.96 -178.382 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 9.6 mp0 -47.78 -50.97 24.1 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 125.181 1.393 . . . . 0.0 111.995 -175.778 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -58.37 -59.99 4.49 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 123.104 0.561 . . . . 0.0 111.028 -175.22 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 29.5 mm100 -62.65 -45.56 92.25 Favored 'General case' 0 CA--C 1.529 0.155 0 C-N-CA 123.23 0.612 . . . . 0.0 111.123 -177.405 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 41.2 ttp180 -56.39 -58.93 5.92 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 123.996 0.918 . . . . 0.0 110.372 179.9 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 62.3 m-20 -62.47 -35.27 78.79 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 123.563 0.745 . . . . 0.0 111.343 -176.752 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -62.52 -48.92 77.42 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 122.811 0.444 . . . . 0.0 110.868 175.232 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 59.6 mtpt -59.97 -46.82 88.18 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 123.603 0.761 . . . . 0.0 110.823 178.579 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 24.9 mm -54.41 -57.45 6.18 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.261 0 C-N-CA 123.708 0.803 . . . . 0.0 109.658 174.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 82.0 tttt -80.47 59.2 3.42 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.598 1.159 . . . . 0.0 109.787 178.66 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 46.5 t -168.86 -46.32 0.02 OUTLIER 'General case' 0 N--CA 1.456 -0.174 0 C-N-CA 126.507 1.923 . . . . 0.0 107.929 179.824 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 53.2 mt -53.12 -54.21 18.49 Favored 'Isoleucine or valine' 0 C--N 1.342 0.277 0 C-N-CA 123.717 0.807 . . . . 0.0 109.075 169.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 9.8 ptp180 -82.28 64.4 6.92 Favored 'General case' 0 C--N 1.342 0.248 0 CA-C-O 121.069 0.461 . . . . 0.0 111.216 175.749 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 . . . . . 0 CA--C 1.533 0.299 0 C-N-CA 123.474 0.71 . . . . 0.0 109.613 169.816 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 80.5 mt-30 . . . . . 0 N--CA 1.453 -0.317 0 CA-C-O 117.903 -1.046 . . . . 0.0 113.553 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 -51.68 -39.06 57.56 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 120.286 1.403 . . . . 0.0 111.451 175.535 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 25.6 mmm180 -56.32 -65.96 0.52 Allowed 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 124.079 0.952 . . . . 0.0 110.778 175.794 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 58.2 mtp180 -50.5 -43.56 55.67 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 125.234 1.413 . . . . 0.0 111.561 178.812 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 80.9 t80 -61.04 -53.8 52.69 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 126.919 2.087 . . . . 0.0 111.695 -177.239 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -72.02 -32.59 67.29 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 118.468 0.576 . . . . 0.0 111.171 -179.75 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 25.5 mm-40 -61.46 -42.39 98.7 Favored 'General case' 0 CA--C 1.532 0.269 0 O-C-N 121.628 -0.67 . . . . 0.0 110.182 172.763 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.35 -47.93 83.64 Favored 'General case' 0 N--CA 1.456 -0.172 0 C-N-CA 123.198 0.599 . . . . 0.0 110.483 176.191 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 34.1 tp -50.6 -44.47 57.04 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.682 1.193 . . . . 0.0 110.991 175.419 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 28.1 m170 -78.54 -40.21 35.62 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 123.751 0.82 . . . . 0.0 113.188 -174.113 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.31 140.89 94.48 Favored Pre-proline 0 CA--C 1.537 0.446 0 CA-C-N 119.056 0.844 . . . . 0.0 111.36 -170.011 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_endo -78.86 -37.83 0.55 Allowed 'Trans proline' 0 N--CA 1.455 -0.78 0 C-N-CA 123.289 2.659 . . . . 0.0 112.43 -178.032 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 3.4 p-10 -58.14 -40.85 82.37 Favored 'General case' 0 C--N 1.341 0.23 0 N-CA-C 113.798 1.036 . . . . 0.0 113.798 -169.808 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 68.2 mt -70.3 117.91 12.45 Favored 'General case' 0 N--CA 1.455 -0.186 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 173.019 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 32.9 p-10 -73.1 176.65 5.63 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 123.376 0.67 . . . . 0.0 110.73 178.779 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.9 mp0 -81.54 55.82 2.77 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 123.645 0.778 . . . . 0.0 109.953 179.507 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 56.5 mt-10 -147.17 -60.92 0.28 Allowed 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 126.881 2.072 . . . . 0.0 105.958 169.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 37.2 mm-40 -67.81 -44.08 78.14 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 123.892 0.877 . . . . 0.0 110.439 178.709 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 20.1 ttm180 -58.63 -55.96 28.38 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 123.072 0.549 . . . . 0.0 109.634 177.846 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 22.9 m120 -62.07 -37.91 86.82 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-O 119.158 -0.449 . . . . 0.0 111.374 -177.325 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.3 -48.72 80.58 Favored 'General case' 0 C--N 1.341 0.21 0 CA-C-N 118.239 0.472 . . . . 0.0 110.935 175.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 25.0 mmtp -56.73 -56.86 16.13 Favored 'General case' 0 C--N 1.341 0.203 0 C-N-CA 123.127 0.571 . . . . 0.0 110.338 176.421 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 23.1 mm -50.98 -57.74 2.53 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.235 0 C-N-CA 123.948 0.899 . . . . 0.0 110.408 -179.151 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -53.28 -50.38 64.98 Favored 'General case' 0 N--CA 1.456 -0.164 0 C-N-CA 125.065 1.346 . . . . 0.0 111.044 -179.134 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 35.4 t -58.33 -46.26 86.56 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.694 0.798 . . . . 0.0 111.492 -179.09 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 59.6 mt -65.8 -50.13 72.7 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 C-N-CA 123.008 0.523 . . . . 0.0 110.558 -175.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 18.5 ptp180 -66.51 -33.72 76.32 Favored 'General case' 0 C--N 1.342 0.272 0 CA-C-N 118.223 0.465 . . . . 0.0 112.044 179.149 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 37.3 t70 . . . . . 0 CA--C 1.531 0.231 0 N-CA-C 108.5 -0.926 . . . . 0.0 108.5 171.881 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 17.6 tt0 . . . . . 0 CA--C 1.534 0.337 0 CA-C-O 120.964 0.412 . . . . 0.0 110.725 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 19.1 tp60 -163.54 -56.91 0.04 OUTLIER 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 124.435 1.094 . . . . 0.0 110.059 179.288 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 30.9 tpt180 -72.39 -77.98 0.09 Allowed 'General case' 0 C--N 1.341 0.227 0 C-N-CA 122.854 0.461 . . . . 0.0 110.895 -172.701 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.77 -26.83 66.03 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 122.672 0.389 . . . . 0.0 111.562 178.733 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 76.3 t80 -61.22 -56.66 18.12 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 126.425 1.89 . . . . 0.0 110.514 175.486 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 55.7 t80 -58.47 -49.64 76.63 Favored 'General case' 0 C--N 1.341 0.207 0 C-N-CA 122.649 0.38 . . . . 0.0 110.215 176.79 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -56.89 -44.73 82.61 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 122.838 0.455 . . . . 0.0 111.451 -177.827 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.95 -53.87 52.76 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 123.589 0.755 . . . . 0.0 111.49 179.719 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 55.1 tp -63.45 -52.67 60.43 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 122.766 0.426 . . . . 0.0 110.554 -178.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 24.8 m-70 -81.43 64.39 6.13 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 124.465 1.106 . . . . 0.0 109.696 -179.084 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -150.82 115.25 3.22 Favored Pre-proline 0 CA--C 1.533 0.302 0 C-N-CA 124.89 1.276 . . . . 0.0 108.181 175.853 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 94.4 Cg_endo -77.82 -25.11 8.01 Favored 'Trans proline' 0 N--CA 1.455 -0.754 0 C-N-CA 123.249 2.633 . . . . 0.0 112.052 -177.85 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 -56.13 -55.18 36.18 Favored 'General case' 0 C--N 1.342 0.265 0 C-N-CA 123.775 0.83 . . . . 0.0 110.619 -178.796 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 91.0 mt -79.41 141.37 36.9 Favored 'General case' 0 N--CA 1.453 -0.28 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 172.64 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 43.8 p-10 -96.68 176.51 5.98 Favored 'General case' 0 C--O 1.233 0.189 0 C-N-CA 124.493 1.117 . . . . 0.0 110.396 179.485 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -79.37 62.4 3.7 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 124.123 0.969 . . . . 0.0 110.453 175.514 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 64.8 mt-10 -148.2 -47.27 0.16 Allowed 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 127.18 2.192 . . . . 0.0 106.794 169.773 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 22.9 mm100 -80.34 -56.65 4.05 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 124.063 0.945 . . . . 0.0 109.71 173.365 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 21.7 ptt180 -68.0 -41.83 81.66 Favored 'General case' 0 C--N 1.341 0.23 0 CA-C-O 119.526 -0.273 . . . . 0.0 111.151 -173.722 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 43.2 p-10 -62.93 -35.81 81.32 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 117.951 0.341 . . . . 0.0 111.622 -178.112 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -60.73 -44.81 96.18 Favored 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 123.687 0.795 . . . . 0.0 110.567 175.199 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 57.0 mtmt -61.44 -48.91 79.0 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-O 119.423 -0.322 . . . . 0.0 110.712 175.729 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 27.9 mm -55.93 -45.02 79.86 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 C-N-CA 124.056 0.942 . . . . 0.0 111.326 179.294 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 88.6 mttt -61.5 -47.43 85.68 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 123.704 0.801 . . . . 0.0 110.689 175.425 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 23.1 t -61.92 -43.57 98.57 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 123.915 0.886 . . . . 0.0 112.012 -177.589 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 58.4 mt -61.59 -35.58 68.0 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.222 0 C-N-CA 124.102 0.961 . . . . 0.0 109.905 177.401 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 85.3 mtm180 -78.31 52.59 1.15 Allowed 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.27 0.628 . . . . 0.0 111.479 173.248 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 . . . . . 0 CA--C 1.532 0.273 0 C-N-CA 124.491 1.116 . . . . 0.0 109.445 169.579 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 26.8 mt-30 . . . . . 0 CA--C 1.536 0.407 0 N-CA-C 112.061 0.393 . . . . 0.0 112.061 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 11.9 tp-100 -66.38 -46.08 77.87 Favored 'General case' 0 C--N 1.341 0.23 0 CA-C-N 118.944 0.793 . . . . 0.0 110.042 179.638 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 9.1 mmm180 -58.4 -36.59 73.79 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.785 0.834 . . . . 0.0 111.426 173.042 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 12.0 mmp_? -68.52 -37.22 79.84 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 123.581 0.753 . . . . 0.0 110.534 179.634 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 15.6 m-30 -65.29 -48.86 71.67 Favored 'General case' 0 N--CA 1.455 -0.196 0 CA-C-O 119.428 -0.32 . . . . 0.0 110.157 172.198 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 21.3 m-85 -79.39 60.27 3.12 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 123.904 0.882 . . . . 0.0 109.987 175.716 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.7 tm-20 -175.57 -50.33 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 127.182 2.193 . . . . 0.0 106.99 -174.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -73.8 -53.03 11.18 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 124.179 0.992 . . . . 0.0 110.896 175.856 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 58.5 tp -73.4 -54.89 7.22 Favored 'General case' 0 C--N 1.34 0.166 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 175.157 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 56.0 m-70 -84.01 59.78 5.48 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 123.423 0.689 . . . . 0.0 109.696 178.898 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -94.57 137.62 22.53 Favored Pre-proline 0 CA--C 1.533 0.322 0 C-N-CA 124.439 1.096 . . . . 0.0 108.239 174.531 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_exo -42.43 -52.94 4.01 Favored 'Trans proline' 0 N--CA 1.458 -0.59 0 C-N-CA 124.004 3.136 . . . . 0.0 114.136 173.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 5.9 p-10 -160.31 131.94 5.95 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 123.621 0.768 . . . . 0.0 110.54 -179.573 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 92.8 mt -140.5 -126.95 0.11 Allowed 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 125.4 1.48 . . . . 0.0 107.104 172.704 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 51.6 p-10 -155.07 23.58 0.43 Allowed 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.768 0.827 . . . . 0.0 111.957 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 74.17 -54.28 0.68 Allowed 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 125.91 1.684 . . . . 0.0 112.109 -177.47 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -52.58 -59.64 4.22 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 124.465 1.106 . . . . 0.0 110.24 178.067 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 83.8 mt-30 -58.82 -43.31 90.57 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 124.803 1.241 . . . . 0.0 110.897 178.652 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 59.2 ttm-85 -55.51 -54.98 37.13 Favored 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 124.807 1.243 . . . . 0.0 111.218 -177.502 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 28.8 m-80 -71.23 -38.16 71.99 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 123.061 0.544 . . . . 0.0 111.146 179.804 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.19 -43.74 87.69 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 118.434 0.561 . . . . 0.0 111.233 177.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 58.6 mtpt -59.59 -50.99 71.76 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 123.129 0.571 . . . . 0.0 109.929 175.709 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 11.6 mm -52.99 -51.75 35.23 Favored 'Isoleucine or valine' 0 C--N 1.341 0.226 0 C-N-CA 123.019 0.527 . . . . 0.0 111.045 178.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 67.6 mttm -57.68 -49.63 75.85 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 123.527 0.731 . . . . 0.0 110.878 179.683 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 32.5 t -57.77 -51.29 70.16 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 124.072 0.949 . . . . 0.0 111.472 -179.119 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 67.1 mt -58.97 -58.26 7.66 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.223 0 C-N-CA 124.765 1.226 . . . . 0.0 109.435 179.722 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 61.1 ttm-85 -55.44 -42.28 73.99 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 125.136 1.374 . . . . 0.0 111.39 -175.721 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 37.9 t70 . . . . . 0 CA--C 1.534 0.343 0 C-N-CA 123.957 0.903 . . . . 0.0 109.249 172.762 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 17.4 mm100 . . . . . 0 C--O 1.225 -0.228 0 CA-C-O 119.092 -0.48 . . . . 0.0 110.747 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 16.1 mm100 -67.3 -38.64 85.32 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 123.753 0.821 . . . . 0.0 111.447 -177.188 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 4.0 tmt_? -62.84 -54.95 30.93 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 124.432 1.093 . . . . 0.0 110.265 176.531 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 89.4 mtt-85 -67.56 -32.73 73.7 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 124.067 0.947 . . . . 0.0 111.185 -177.144 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 3.5 t80 -56.98 -53.79 54.06 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 125.275 1.43 . . . . 0.0 110.294 169.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 70.9 t80 -57.42 -48.06 80.13 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 123.377 0.671 . . . . 0.0 110.724 179.747 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 73.2 mt-10 -56.13 -50.02 72.28 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 123.119 0.568 . . . . 0.0 111.077 175.791 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -56.81 -45.09 82.49 Favored 'General case' 0 C--N 1.341 0.207 0 C-N-CA 124.138 0.975 . . . . 0.0 111.462 179.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 1.1 tt -50.8 -41.26 57.05 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 124.454 1.102 . . . . 0.0 109.95 175.01 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 11.9 m-70 -100.52 25.64 7.53 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 124.437 1.095 . . . . 0.0 112.678 -176.169 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 80.0 m-20 -69.05 151.98 96.97 Favored Pre-proline 0 CA--C 1.538 0.486 0 CA-C-N 119.13 0.877 . . . . 0.0 109.946 174.884 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_exo -50.75 -63.64 0.27 Allowed 'Trans proline' 0 C--N 1.351 0.663 0 C-N-CA 123.962 3.108 . . . . 0.0 114.46 -173.831 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 -162.96 84.61 0.52 Allowed 'General case' 0 N--CA 1.456 -0.141 0 C-N-CA 123.189 0.596 . . . . 0.0 109.572 -176.077 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 89.6 mt -122.94 129.24 51.33 Favored 'General case' 0 N--CA 1.456 -0.135 0 N-CA-C 106.267 -1.753 . . . . 0.0 106.267 172.747 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 1.7 p30 -69.24 163.93 23.88 Favored 'General case' 0 CA--C 1.529 0.157 0 N-CA-C 112.883 0.697 . . . . 0.0 112.883 -169.533 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 -58.02 -28.52 64.52 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 124.372 1.069 . . . . 0.0 113.074 -172.002 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -57.64 -50.29 73.66 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 119.069 0.849 . . . . 0.0 109.902 173.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 47.5 mt-30 -65.39 -40.13 93.07 Favored 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 124.278 1.031 . . . . 0.0 110.378 -179.885 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 5.8 mmp_? -62.25 -65.0 0.75 Allowed 'General case' 0 C--N 1.342 0.257 0 N-CA-C 109.244 -0.651 . . . . 0.0 109.244 177.896 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 61.2 t30 -50.14 -38.7 40.47 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 124.909 1.284 . . . . 0.0 112.368 -176.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -54.6 -49.25 70.91 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 118.297 0.499 . . . . 0.0 111.103 174.013 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 95.5 mttt -62.54 -55.87 23.35 Favored 'General case' 0 C--N 1.342 0.241 0 CA-C-O 118.938 -0.553 . . . . 0.0 110.807 173.831 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 4.9 mm -57.73 -37.96 62.4 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 CA-C-N 118.294 0.497 . . . . 0.0 110.499 -171.056 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 17.6 tppt? -60.2 -50.98 71.51 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 124.265 1.026 . . . . 0.0 110.453 176.701 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 18.1 m -59.55 -44.96 93.09 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.59 0.756 . . . . 0.0 111.037 179.067 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 48.8 mt -62.69 -47.72 91.57 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 C-N-CA 125.386 1.474 . . . . 0.0 110.226 -179.347 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 78.4 mtm180 -56.91 -46.53 81.92 Favored 'General case' 0 C--N 1.34 0.193 0 C-N-CA 123.77 0.828 . . . . 0.0 110.282 174.325 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 53.0 m-20 . . . . . 0 CA--C 1.535 0.381 0 C-N-CA 123.773 0.829 . . . . 0.0 110.992 -178.846 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 16.6 mm100 . . . . . 0 CA--C 1.53 0.203 0 N-CA-C 110.557 -0.164 . . . . 0.0 110.557 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 62.0 mm-40 -59.35 -39.57 83.62 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 124.015 0.926 . . . . 0.0 111.63 179.25 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 9.7 mmm180 -58.95 -56.91 16.11 Favored 'General case' 0 N--CA 1.456 -0.167 0 CA-C-N 118.143 0.428 . . . . 0.0 110.909 176.406 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 19.8 ptt180 -66.07 -30.69 71.25 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 112.557 0.577 . . . . 0.0 112.557 -177.582 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 15.5 m-85 -58.69 -52.01 67.52 Favored 'General case' 0 C--N 1.343 0.311 0 CA-C-N 118.494 0.588 . . . . 0.0 110.344 169.874 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 47.5 t80 -58.37 -48.65 79.94 Favored 'General case' 0 C--N 1.341 0.203 0 C-N-CA 122.994 0.517 . . . . 0.0 110.657 -179.807 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -56.99 -46.99 81.87 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 123.355 0.662 . . . . 0.0 111.03 -179.742 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.62 -54.09 44.82 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 123.402 0.681 . . . . 0.0 111.514 178.716 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 61.3 tp -59.86 -45.77 91.39 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 124.572 1.149 . . . . 0.0 111.215 -176.428 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 22.9 m-70 -89.28 16.24 7.71 Favored 'General case' 0 CA--C 1.537 0.481 0 C-N-CA 124.309 1.043 . . . . 0.0 111.994 -179.617 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -68.22 135.45 91.33 Favored Pre-proline 0 CA--C 1.533 0.311 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 172.863 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -67.67 -29.16 36.61 Favored 'Trans proline' 0 N--CA 1.457 -0.651 0 C-N-CA 122.456 2.104 . . . . 0.0 112.668 -176.39 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 27.5 m-80 -83.1 62.88 6.84 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.685 0.794 . . . . 0.0 110.516 -175.884 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 20.7 mt -80.3 87.1 5.6 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-O 121.683 0.754 . . . . 0.0 110.234 177.794 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 52.3 p-10 -98.7 17.36 19.47 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 125.602 1.561 . . . . 0.0 110.775 171.413 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.9 mp0 71.46 -55.98 0.64 Allowed 'General case' 0 C--N 1.345 0.408 0 C-N-CA 127.223 2.209 . . . . 0.0 111.277 -174.035 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -45.24 -54.03 7.55 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 126.246 1.819 . . . . 0.0 112.219 -178.191 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 37.1 mt-30 -60.52 -54.13 49.15 Favored 'General case' 0 C--N 1.34 0.176 0 C-N-CA 123.301 0.641 . . . . 0.0 110.56 -176.34 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 78.3 ttt180 -54.33 -56.19 20.99 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 124.117 0.967 . . . . 0.0 110.998 -179.253 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 11.4 m-80 -59.74 -50.3 74.38 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 122.939 0.495 . . . . 0.0 110.854 -177.537 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -54.64 -50.21 68.69 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 123.262 0.625 . . . . 0.0 111.409 -179.828 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 27.1 mmmt -61.39 -54.02 49.1 Favored 'General case' 0 N--CA 1.454 -0.225 0 C-N-CA 122.769 0.428 . . . . 0.0 110.83 179.603 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 39.7 mt -54.87 -46.53 75.68 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 C-N-CA 123.282 0.633 . . . . 0.0 110.999 -178.159 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 60.9 mtpt -58.16 -48.25 80.85 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 123.888 0.875 . . . . 0.0 110.972 176.227 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 50.3 m -58.29 -52.7 64.49 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 117.917 0.326 . . . . 0.0 111.121 179.13 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 41.1 mt -63.37 -49.06 84.38 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.251 0 C-N-CA 124.312 1.045 . . . . 0.0 110.751 -173.891 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 12.3 ptm180 -64.81 -34.79 79.2 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 118.018 0.372 . . . . 0.0 111.634 -177.087 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 84.1 m-20 . . . . . 0 C--N 1.341 0.237 0 C-N-CA 122.761 0.424 . . . . 0.0 110.235 175.539 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 90.0 mt-30 . . . . . 0 N--CA 1.453 -0.304 0 CA-C-O 118.921 -0.562 . . . . 0.0 112.154 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 11.5 tt0 -60.23 -32.56 71.24 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 118.876 0.762 . . . . 0.0 111.398 177.254 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 5.1 mmp_? -64.14 -47.02 81.53 Favored 'General case' 0 N--CA 1.456 -0.151 0 C-N-CA 123.245 0.618 . . . . 0.0 110.12 173.858 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 79.4 mtt85 -60.49 -44.33 96.07 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 123.42 0.688 . . . . 0.0 110.139 178.151 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 14.1 m-30 -57.67 -45.71 85.23 Favored 'General case' 0 C--O 1.225 -0.215 0 C-N-CA 123.562 0.745 . . . . 0.0 111.592 174.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 87.0 t80 -58.43 -52.27 66.34 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 118.648 0.658 . . . . 0.0 110.373 178.795 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -56.9 -52.41 65.25 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.564 0.746 . . . . 0.0 111.178 179.841 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.23 -51.13 70.87 Favored 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 124.739 1.216 . . . . 0.0 111.555 -178.004 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 59.6 tp -62.11 -50.2 72.87 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 124.541 1.136 . . . . 0.0 110.34 -177.548 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 18.0 m-70 -82.17 62.78 6.06 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.8 0.84 . . . . 0.0 109.674 178.008 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -154.43 121.93 2.89 Favored Pre-proline 0 CA--C 1.535 0.371 0 C-N-CA 123.916 0.886 . . . . 0.0 109.414 176.491 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo -80.06 -32.75 1.31 Allowed 'Trans proline' 0 N--CA 1.456 -0.735 0 C-N-CA 123.458 2.772 . . . . 0.0 112.319 -178.311 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 30.3 t30 -53.52 -47.88 69.52 Favored 'General case' 0 C--N 1.343 0.298 0 C-N-CA 124.231 1.012 . . . . 0.0 110.923 -176.246 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -75.87 88.51 2.88 Favored 'General case' 0 N--CA 1.455 -0.219 0 N-CA-C 105.272 -2.121 . . . . 0.0 105.272 169.5 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 -81.69 55.45 2.7 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.532 1.133 . . . . 0.0 112.811 -169.639 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 15.3 tt0 69.88 164.94 0.27 Allowed 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.879 1.272 . . . . 0.0 110.969 -179.353 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.9 tp10 71.8 -64.01 0.4 Allowed 'General case' 0 N--CA 1.456 -0.163 0 C-N-CA 127.031 2.132 . . . . 0.0 110.775 -178.033 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 33.4 mm-40 -59.58 -45.39 92.02 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 124.341 1.057 . . . . 0.0 109.631 171.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 39.3 ttp180 -56.13 -53.32 58.51 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 125.684 1.594 . . . . 0.0 110.513 176.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 9.8 m120 -61.81 -43.45 98.82 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 124.467 1.107 . . . . 0.0 110.742 -179.579 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -60.83 -51.23 70.18 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 124.081 0.952 . . . . 0.0 111.206 -178.541 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 61.1 pttt -66.52 -34.9 78.95 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 118.345 0.52 . . . . 0.0 111.594 -178.101 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 5.3 mt -58.95 -48.08 87.67 Favored 'Isoleucine or valine' 0 C--N 1.342 0.251 0 CA-C-O 118.962 -0.542 . . . . 0.0 109.84 170.407 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 52.0 tptt -60.95 -37.32 81.93 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 118.754 0.706 . . . . 0.0 111.435 179.228 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 19.4 m -59.61 -41.63 90.78 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 118.507 0.594 . . . . 0.0 111.188 174.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 70.7 mt -65.61 -60.61 2.44 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.453 0 C-N-CA 123.831 0.852 . . . . 0.0 109.709 177.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 3.5 ptm180 -92.09 69.47 5.31 Favored 'General case' 0 C--N 1.341 0.219 0 C-N-CA 123.783 0.833 . . . . 0.0 110.191 174.197 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 38.7 t70 . . . . . 0 CA--C 1.532 0.253 0 N-CA-C 109.91 -0.404 . . . . 0.0 109.91 178.954 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 29.1 mm100 . . . . . 0 N--CA 1.453 -0.285 0 CA-C-O 118.189 -0.91 . . . . 0.0 112.012 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -36.42 -41.11 0.27 Allowed 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 125.937 1.695 . . . . 0.0 114.204 177.673 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 33.3 tpt85 -69.97 -53.98 15.33 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.352 0.661 . . . . 0.0 111.075 -178.738 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 9.8 mpt_? -61.47 -47.29 86.37 Favored 'General case' 0 CA--C 1.53 0.212 0 C-N-CA 124.446 1.098 . . . . 0.0 109.577 -178.912 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 88.4 t80 -49.42 -51.64 33.96 Favored 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 127.709 2.403 . . . . 0.0 111.33 172.67 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 40.7 t80 -58.41 -47.41 84.01 Favored 'General case' 0 C--N 1.341 0.197 0 CA-C-O 119.019 -0.515 . . . . 0.0 110.803 177.388 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 46.4 mm-40 -58.43 -51.69 68.75 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 118.68 0.673 . . . . 0.0 110.69 178.909 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -56.45 -45.59 80.76 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 124.374 1.07 . . . . 0.0 111.72 -178.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 57.7 tp -64.87 -53.47 46.11 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 123.9 0.88 . . . . 0.0 110.384 178.506 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 16.8 m-70 -82.28 57.99 3.86 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 124.643 1.177 . . . . 0.0 109.877 -179.782 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -156.51 78.02 4.15 Favored Pre-proline 0 CA--C 1.534 0.356 0 C-N-CA 124.904 1.282 . . . . 0.0 107.79 178.266 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -82.47 59.08 6.78 Favored 'Trans proline' 0 N--CA 1.456 -0.683 0 C-N-CA 124.323 3.349 . . . . 0.0 110.568 -172.659 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 3.1 p-10 -154.47 -30.9 0.11 Allowed 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 124.806 1.242 . . . . 0.0 111.556 -176.372 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -62.83 153.61 32.55 Favored 'General case' 0 C--N 1.343 0.293 0 CA-C-N 118.742 0.701 . . . . 0.0 109.995 170.782 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 8.9 p30 -65.92 132.48 48.73 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 175.247 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -80.76 65.27 5.84 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 124.276 1.03 . . . . 0.0 108.585 -178.295 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.9 tp10 -152.07 -52.59 0.12 Allowed 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 126.805 2.042 . . . . 0.0 106.636 179.515 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 35.0 mt-30 -63.62 -65.45 0.68 Allowed 'General case' 0 C--N 1.341 0.218 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 171.678 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 18.7 ptt180 -61.59 -33.62 74.2 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-O 119.075 -0.488 . . . . 0.0 111.728 178.266 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 24.5 t-20 -63.88 -49.4 72.87 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 118.482 0.583 . . . . 0.0 111.191 179.031 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.34 -47.55 83.42 Favored 'General case' 0 C--N 1.339 0.15 0 C-N-CA 123.552 0.741 . . . . 0.0 110.864 178.159 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 57.8 mtpt -56.36 -61.19 2.57 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 123.51 0.724 . . . . 0.0 110.176 177.266 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 38.5 mt -49.89 -53.0 11.85 Favored 'Isoleucine or valine' 0 C--N 1.338 0.076 0 C-N-CA 124.946 1.298 . . . . 0.0 110.994 -178.843 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 6.9 ttpm? -53.37 -54.05 42.3 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 124.429 1.092 . . . . 0.0 111.311 178.86 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 51.0 m -56.82 -48.12 78.72 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 122.656 0.382 . . . . 0.0 111.647 179.883 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 67.4 mt -62.27 -50.83 78.39 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.267 0 C-N-CA 124.314 1.046 . . . . 0.0 110.697 -175.278 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 36.2 ptt85 -71.93 -31.85 66.77 Favored 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 112.484 0.55 . . . . 0.0 112.484 -177.301 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 87.6 m-20 . . . . . 0 C--N 1.341 0.226 0 CA-C-N 118.212 0.46 . . . . 0.0 110.855 178.689 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 12.5 mm100 . . . . . 0 CA--C 1.531 0.233 0 CA-C-O 119.901 -0.095 . . . . 0.0 111.157 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 82.2 mt-30 -53.35 -42.49 66.87 Favored 'General case' 0 C--N 1.34 0.182 0 C-N-CA 124.317 1.047 . . . . 0.0 111.337 177.362 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 80.4 mmt-85 -64.26 -42.05 96.65 Favored 'General case' 0 N--CA 1.456 -0.165 0 C-N-CA 123.4 0.68 . . . . 0.0 110.611 -178.16 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.48 -40.25 95.32 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-O 119.546 -0.264 . . . . 0.0 110.54 173.951 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 20.6 m-85 -62.66 -34.07 76.34 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-O 118.716 -0.659 . . . . 0.0 111.496 175.673 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 19.5 m-85 -76.72 55.12 1.03 Allowed 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 119.075 0.852 . . . . 0.0 110.342 172.449 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -178.56 -55.93 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 127.183 2.193 . . . . 0.0 107.676 -179.034 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -80.53 -47.52 14.12 Favored 'General case' 0 C--N 1.34 0.185 0 C-N-CA 123.951 0.9 . . . . 0.0 111.579 -179.366 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.0 tt -78.01 -56.49 4.44 Favored 'General case' 0 C--N 1.338 0.072 0 N-CA-C 107.956 -1.127 . . . . 0.0 107.956 -178.079 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 62.7 m-70 -84.45 54.41 2.99 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 124.422 1.089 . . . . 0.0 109.392 176.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -87.45 141.55 32.46 Favored Pre-proline 0 CA--C 1.533 0.318 0 C-N-CA 123.649 0.779 . . . . 0.0 109.785 -179.818 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_exo -43.52 -59.97 0.9 Allowed 'Trans proline' 0 N--CA 1.455 -0.771 0 C-N-CA 124.212 3.275 . . . . 0.0 115.343 173.015 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 9.4 p30 -157.53 25.91 0.29 Allowed 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 115.001 1.482 . . . . 0.0 115.001 -169.969 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 28.5 mt -63.1 133.24 54.14 Favored 'General case' 0 C--N 1.34 0.182 0 CA-C-N 119.647 1.112 . . . . 0.0 109.375 169.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 14.2 p30 -65.05 163.82 14.05 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 123.715 0.806 . . . . 0.0 110.527 175.847 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -51.48 -49.11 62.46 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 124.05 0.94 . . . . 0.0 112.314 -175.046 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -58.2 -57.23 13.79 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.312 0.645 . . . . 0.0 110.959 -177.331 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 92.0 mm-40 -66.62 -43.47 84.67 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 123.073 0.549 . . . . 0.0 111.495 -175.217 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 22.3 ttm-85 -56.02 -54.55 43.54 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.761 0.824 . . . . 0.0 109.619 175.889 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -57.17 -40.7 77.81 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 123.877 0.871 . . . . 0.0 111.624 178.282 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -60.42 -45.59 93.07 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 123.061 0.544 . . . . 0.0 111.088 178.429 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 12.3 mmmm -58.75 -47.48 84.51 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 122.591 0.356 . . . . 0.0 110.707 175.56 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 48.2 mm -57.15 -44.49 83.42 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 CA-C-N 117.949 0.34 . . . . 0.0 110.701 177.007 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 1.3 tppm? -61.4 -39.87 92.3 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 123.529 0.732 . . . . 0.0 111.015 178.23 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 20.1 m -60.66 -42.07 96.27 Favored 'General case' 0 CA--C 1.533 0.302 0 O-C-N 121.732 -0.605 . . . . 0.0 111.187 175.301 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 43.2 mt -72.1 -40.37 66.67 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 C-N-CA 124.103 0.961 . . . . 0.0 111.44 -177.052 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 12.2 ptt180 -133.38 91.88 2.92 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 124.424 1.09 . . . . 0.0 108.244 174.477 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 17.5 p-10 . . . . . 0 CA--C 1.536 0.426 0 C-N-CA 125.946 1.699 . . . . 0.0 112.589 178.261 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 44.3 tt0 . . . . . 0 N--CA 1.453 -0.324 0 CA-C-O 119.417 -0.325 . . . . 0.0 110.503 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 18.5 pt20 -59.41 -30.64 68.61 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 123.916 0.887 . . . . 0.0 111.789 -179.561 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 49.5 ttt-85 -66.1 -59.33 3.88 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.832 0.853 . . . . 0.0 110.999 177.278 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 22.8 mtp-105 -56.52 -38.15 71.42 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 124.748 1.219 . . . . 0.0 111.124 177.382 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 23.5 t80 -60.9 -53.46 56.98 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 125.61 1.564 . . . . 0.0 110.824 178.021 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 45.0 t80 -57.11 -49.12 76.88 Favored 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 123.806 0.842 . . . . 0.0 110.11 177.203 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 5.9 tm-20 -53.45 -57.21 11.46 Favored 'General case' 0 C--N 1.341 0.199 0 C-N-CA 123.549 0.74 . . . . 0.0 109.978 178.47 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -53.49 -55.66 23.5 Favored 'General case' 0 N--CA 1.456 -0.174 0 C-N-CA 124.052 0.941 . . . . 0.0 111.232 -178.084 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 63.3 tp -59.1 -54.65 44.6 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 124.462 1.105 . . . . 0.0 111.754 -176.467 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 21.3 m-70 -70.95 -37.78 72.84 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 122.956 0.502 . . . . 0.0 112.11 -173.532 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -67.86 120.63 75.17 Favored Pre-proline 0 CA--C 1.535 0.386 0 CA-C-O 118.957 -0.544 . . . . 0.0 110.737 -176.237 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 75.4 Cg_endo -80.62 -29.74 2.17 Favored 'Trans proline' 0 N--CA 1.455 -0.775 0 C-N-CA 123.39 2.727 . . . . 0.0 111.872 179.313 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 14.6 m120 -58.66 -34.79 71.61 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 125.062 1.345 . . . . 0.0 113.001 -170.803 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 85.6 mt -55.21 135.06 49.92 Favored 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 173.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 30.2 p-10 -83.59 48.08 1.37 Allowed 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 123.768 0.827 . . . . 0.0 112.683 -169.894 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 5.6 tm-20 70.81 -64.02 0.39 Allowed 'General case' 0 C--N 1.342 0.28 0 C-N-CA 126.071 1.748 . . . . 0.0 112.201 177.456 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 24.9 pt-20 -54.61 -44.88 73.49 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.89 0.876 . . . . 0.0 112.182 -174.893 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 45.1 mt-30 -64.24 -52.2 59.92 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 123.295 0.638 . . . . 0.0 110.671 178.296 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 26.5 ttp-105 -52.29 -47.85 65.66 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 124.765 1.226 . . . . 0.0 111.354 178.726 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 4.8 m-80 -70.98 -40.29 71.98 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 123.607 0.763 . . . . 0.0 111.379 -178.847 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.89 -45.49 92.33 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.251 0.62 . . . . 0.0 111.065 177.413 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 8.3 mmmm -56.1 -58.5 7.65 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 123.684 0.794 . . . . 0.0 109.44 174.013 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 50.8 mt -55.02 -53.43 34.14 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.275 0 C-N-CA 124.392 1.077 . . . . 0.0 112.209 -175.246 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.65 -43.03 97.96 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 118.557 0.617 . . . . 0.0 111.147 -176.553 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 30.4 t -58.41 -50.95 71.86 Favored 'General case' 0 C--N 1.342 0.263 0 C-N-CA 123.448 0.699 . . . . 0.0 110.211 178.071 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 48.5 mt -55.1 -48.49 76.02 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.189 0 C-N-CA 125.228 1.411 . . . . 0.0 110.894 177.86 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -60.09 -50.78 72.34 Favored 'General case' 0 N--CA 1.455 -0.181 0 CA-C-O 119.187 -0.435 . . . . 0.0 111.208 179.902 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 2.8 p30 . . . . . 0 CA--C 1.536 0.406 0 N-CA-C 113.297 0.851 . . . . 0.0 113.297 -177.979 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 95.4 mt-30 . . . . . 0 N--CA 1.448 -0.525 0 N-CA-C 107.938 -1.134 . . . . 0.0 107.938 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 21.5 tp60 -116.44 -51.88 2.59 Favored 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 124.684 1.193 . . . . 0.0 108.514 174.129 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 13.8 tpt180 -65.31 -55.01 20.7 Favored 'General case' 0 C--N 1.34 0.189 0 C-N-CA 123.25 0.62 . . . . 0.0 109.84 174.032 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 81.5 mtp180 -52.66 -47.23 67.26 Favored 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 124.295 1.038 . . . . 0.0 110.521 178.382 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 8.7 t80 -61.48 -52.45 64.47 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 125.838 1.655 . . . . 0.0 112.095 179.362 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 91.1 t80 -58.26 -43.98 88.17 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 124.341 1.056 . . . . 0.0 110.631 178.54 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -63.78 -43.76 95.38 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.092 0.957 . . . . 0.0 110.849 177.92 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.49 -42.37 98.7 Favored 'General case' 0 C--N 1.341 0.225 0 C-N-CA 123.873 0.869 . . . . 0.0 111.188 176.766 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 58.4 tp -59.46 -51.59 69.23 Favored 'General case' 0 N--CA 1.454 -0.239 0 C-N-CA 123.414 0.685 . . . . 0.0 109.557 176.768 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 22.0 m-70 -93.84 49.52 1.35 Allowed 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 123.881 0.872 . . . . 0.0 110.774 -178.321 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -71.59 165.36 49.81 Favored Pre-proline 0 CA--C 1.539 0.543 0 CA-C-O 118.977 -0.535 . . . . 0.0 110.309 177.35 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -55.49 -65.82 0.1 Allowed 'Trans proline' 0 N--CA 1.457 -0.636 0 C-N-CA 123.148 2.565 . . . . 0.0 112.742 179.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 17.3 t-20 -167.73 70.32 0.09 Allowed 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 123.583 0.753 . . . . 0.0 109.762 -179.744 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -79.91 163.8 24.04 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 172.469 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 50.7 p-10 -79.87 17.87 0.89 Allowed 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 114.328 1.233 . . . . 0.0 114.328 -169.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 13.5 tp10 71.58 -44.92 0.6 Allowed 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 126.17 1.788 . . . . 0.0 113.187 -176.423 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 14.7 tp10 -57.22 -51.46 69.25 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 119.09 0.859 . . . . 0.0 110.638 178.072 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 45.7 mt-30 -62.15 -46.28 89.66 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 124.041 0.936 . . . . 0.0 111.151 178.883 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 45.9 ttm180 -55.42 -51.29 67.35 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 124.607 1.163 . . . . 0.0 110.402 178.455 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 47.6 t30 -61.5 -51.14 69.88 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 124.52 1.128 . . . . 0.0 110.396 179.54 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -54.51 -45.89 73.39 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 124.091 0.957 . . . . 0.0 111.743 -179.647 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 54.6 mmtt -55.62 -53.33 57.82 Favored 'General case' 0 C--N 1.34 0.169 0 C-N-CA 123.095 0.558 . . . . 0.0 110.214 173.06 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 89.9 mt -60.64 -35.21 62.19 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 C-N-CA 123.155 0.582 . . . . 0.0 111.866 -176.263 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 64.1 mttm -63.04 -48.41 78.81 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 119.162 0.892 . . . . 0.0 110.07 170.556 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 15.0 m -74.59 3.28 8.01 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 124.432 1.093 . . . . 0.0 113.459 -178.606 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 57.5 mt -107.85 -61.5 2.48 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.237 0 N-CA-C 106.867 -1.531 . . . . 0.0 106.867 171.543 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 19.7 tpp180 -81.4 68.96 7.93 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 125.187 1.395 . . . . 0.0 108.843 174.948 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 . . . . . 0 CA--C 1.531 0.236 0 N-CA-C 108.501 -0.925 . . . . 0.0 108.501 174.814 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 36.0 tt0 . . . . . 0 N--CA 1.456 -0.152 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 67.6 mt-30 -46.29 -33.8 4.02 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 125.861 1.664 . . . . 0.0 113.124 -169.957 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 44.8 mtt180 -56.34 -72.86 0.07 Allowed 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.446 1.098 . . . . 0.0 111.416 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -64.39 -38.38 90.82 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 124.284 1.033 . . . . 0.0 110.923 -178.743 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 49.2 t80 -59.43 -53.31 59.61 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 126.23 1.812 . . . . 0.0 110.966 -177.594 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 47.7 t80 -62.49 -45.04 94.82 Favored 'General case' 0 C--N 1.341 0.227 0 C-N-CA 123.562 0.745 . . . . 0.0 110.284 175.794 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 15.8 tp10 -55.74 -49.39 73.21 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 122.549 0.339 . . . . 0.0 110.866 -179.097 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.24 -51.46 68.85 Favored 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 123.8 0.84 . . . . 0.0 111.165 179.083 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 57.7 tp -60.65 -57.75 11.38 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 123.915 0.886 . . . . 0.0 111.2 -176.905 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 29.0 m-70 -83.41 61.81 6.39 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 124.738 1.215 . . . . 0.0 109.765 -178.659 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -158.6 120.27 1.93 Allowed Pre-proline 0 CA--C 1.533 0.326 0 C-N-CA 123.911 0.884 . . . . 0.0 109.061 177.69 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -77.9 -27.65 5.68 Favored 'Trans proline' 0 N--CA 1.455 -0.736 0 C-N-CA 123.316 2.677 . . . . 0.0 112.01 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -54.71 -53.68 51.8 Favored 'General case' 0 C--N 1.344 0.341 0 C-N-CA 123.711 0.804 . . . . 0.0 110.218 -179.335 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 81.1 mt -71.03 121.53 18.38 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 107.146 -1.428 . . . . 0.0 107.146 169.625 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 25.3 p30 -72.57 175.54 6.24 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-O 120.749 0.309 . . . . 0.0 110.742 -177.747 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -59.2 -51.39 70.18 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 123.186 0.594 . . . . 0.0 111.972 -171.729 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -62.77 -38.53 90.99 Favored 'General case' 0 CA--C 1.534 0.34 0 N-CA-C 111.867 0.321 . . . . 0.0 111.867 -179.551 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 85.5 mt-30 -62.28 -56.46 18.29 Favored 'General case' 0 C--N 1.34 0.163 0 C-N-CA 123.496 0.718 . . . . 0.0 110.823 178.523 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 31.6 ptt180 -66.29 -32.11 73.33 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 112.098 0.407 . . . . 0.0 112.098 -177.578 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 72.6 m-20 -64.93 -40.01 94.38 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 118.226 0.466 . . . . 0.0 110.864 172.224 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -63.38 -44.4 94.83 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 118.057 0.39 . . . . 0.0 110.669 175.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 11.9 mmmm -55.41 -51.49 66.69 Favored 'General case' 0 C--N 1.341 0.223 0 C-N-CA 123.237 0.615 . . . . 0.0 110.439 174.642 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 33.9 mt -51.74 -53.28 17.7 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.189 0 C-N-CA 123.404 0.682 . . . . 0.0 110.327 175.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 82.2 tttt -65.01 -25.84 68.03 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.039 0.535 . . . . 0.0 112.316 -177.359 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 49.5 m -74.34 -46.96 37.37 Favored 'General case' 0 CA--C 1.529 0.16 0 CA-C-N 118.691 0.678 . . . . 0.0 110.716 175.727 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 40.8 mt -63.72 -62.13 1.35 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.261 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 179.197 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 52.1 ttp85 -78.88 75.89 5.38 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 125.335 1.454 . . . . 0.0 107.72 170.09 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 . . . . . 0 CA--C 1.534 0.333 0 C-N-CA 127.336 2.254 . . . . 0.0 112.529 -178.129 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.4 mp0 . . . . . 0 CA--C 1.533 0.312 0 CA-C-O 119.845 -0.121 . . . . 0.0 111.314 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 22.6 tt0 -54.33 -43.25 71.05 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 125.188 1.395 . . . . 0.0 111.635 176.473 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.48 -58.45 7.97 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 124.157 0.983 . . . . 0.0 109.488 177.226 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -61.39 -38.45 87.07 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-O 118.932 -0.556 . . . . 0.0 111.917 -178.933 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 25.1 m-85 -61.49 -43.79 98.24 Favored 'General case' 0 C--N 1.342 0.241 0 CA-C-N 118.999 0.818 . . . . 0.0 110.917 177.733 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 53.5 t80 -60.16 -46.74 88.64 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 118.082 0.401 . . . . 0.0 110.094 175.112 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 15.5 tp10 -56.38 -45.15 80.67 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 117.95 0.341 . . . . 0.0 110.876 177.934 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.15 -53.73 48.79 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 124.341 1.056 . . . . 0.0 111.336 -178.677 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 58.7 mt -61.95 -54.27 44.14 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 123.5 0.72 . . . . 0.0 110.575 -178.686 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 29.0 m-70 -85.1 66.21 9.63 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.265 1.026 . . . . 0.0 109.276 -177.82 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -127.46 140.34 37.72 Favored Pre-proline 0 CA--C 1.536 0.409 0 C-N-CA 125.743 1.617 . . . . 0.0 108.531 -178.544 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -76.89 -38.73 0.78 Allowed 'Trans proline' 0 N--CA 1.457 -0.636 0 C-N-CA 123.085 2.523 . . . . 0.0 112.841 -178.872 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 35.3 m120 -81.16 74.04 8.18 Favored 'General case' 0 C--N 1.34 0.185 0 C-N-CA 124.262 1.025 . . . . 0.0 110.498 -173.547 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 33.2 mt -98.86 140.14 33.48 Favored 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 112.937 0.717 . . . . 0.0 112.937 -174.762 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 52.1 p-10 -153.79 12.53 0.45 Allowed 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 126.561 1.944 . . . . 0.0 110.197 169.683 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 18.7 tp10 67.02 -47.5 0.47 Allowed 'General case' 0 C--N 1.346 0.449 0 C-N-CA 128.105 2.562 . . . . 0.0 113.177 -171.176 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 5.2 tm-20 -49.05 -45.21 42.52 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 124.789 1.235 . . . . 0.0 111.882 177.637 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 49.4 mm-40 -65.09 -41.54 94.88 Favored 'General case' 0 C--N 1.34 0.192 0 N-CA-C 109.902 -0.407 . . . . 0.0 109.902 -179.438 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 4.4 mmp_? -59.68 -61.85 2.31 Favored 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 177.492 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 17.4 t-20 -45.96 -50.18 15.04 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 126.128 1.771 . . . . 0.0 111.947 -177.878 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -55.7 -44.99 77.91 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 124.182 0.993 . . . . 0.0 111.595 176.259 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 26.1 mtpp -69.4 -42.08 75.56 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-O 118.432 -0.794 . . . . 0.0 111.777 179.635 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 10.3 mm -54.67 -53.97 27.13 Favored 'Isoleucine or valine' 0 C--N 1.345 0.377 0 CA-C-N 119.452 1.024 . . . . 0.0 110.144 -176.385 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 9.8 ptpp? -59.06 -41.41 87.85 Favored 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 111.889 0.329 . . . . 0.0 111.889 -178.579 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 37.6 m -60.49 -44.33 96.06 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 123.011 0.524 . . . . 0.0 111.117 177.559 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 63.1 mt -63.89 -42.55 96.18 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 C-N-CA 123.892 0.877 . . . . 0.0 110.24 179.109 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 34.3 mmt180 -58.89 -39.58 81.87 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 122.98 0.512 . . . . 0.0 110.65 175.608 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 65.9 m-20 . . . . . 0 CA--C 1.532 0.278 0 C-N-CA 122.738 0.415 . . . . 0.0 111.286 178.548 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.3 tp-100 . . . . . 0 CA--C 1.531 0.238 0 N-CA-C 110.905 -0.035 . . . . 0.0 110.905 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 29.1 mm100 -60.86 -36.09 78.28 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-O 118.995 -0.526 . . . . 0.0 111.463 175.519 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.81 -39.46 83.98 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 118.473 0.579 . . . . 0.0 111.251 176.115 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 74.5 mtt85 -61.18 -46.71 89.38 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 118.42 0.554 . . . . 0.0 110.308 175.449 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 21.7 m-85 -61.14 -46.76 89.22 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 122.659 0.384 . . . . 0.0 111.261 175.855 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 52.8 t80 -54.81 -49.92 69.81 Favored 'General case' 0 C--O 1.225 -0.208 0 C-N-CA 124.034 0.933 . . . . 0.0 110.32 179.741 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -57.59 -52.81 63.9 Favored 'General case' 0 CA--C 1.531 0.229 0 N-CA-C 109.712 -0.477 . . . . 0.0 109.712 174.704 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -70.27 9.67 0.56 Allowed 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.885 1.274 . . . . 0.0 114.12 -179.987 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 64.6 tp -123.25 -37.48 2.69 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.457 1.103 . . . . 0.0 110.971 172.672 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 17.2 m-70 -90.95 -28.68 17.9 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.871 1.268 . . . . 0.0 113.464 -174.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -51.07 136.67 28.22 Favored Pre-proline 0 CA--C 1.543 0.687 0 C-N-CA 124.264 1.026 . . . . 0.0 112.297 -174.661 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_exo -45.53 -46.52 14.52 Favored 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 124.541 3.494 . . . . 0.0 115.777 -179.807 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 3.6 t30 -67.38 120.53 14.02 Favored 'General case' 0 C--N 1.34 0.172 0 N-CA-C 109.678 -0.49 . . . . 0.0 109.678 -177.699 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -156.04 130.28 8.76 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 122.86 0.464 . . . . 0.0 111.083 -173.911 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 1.8 p-10 -157.58 33.67 0.27 Allowed 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.11 0.964 . . . . 0.0 111.142 170.043 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.8 tm-20 72.33 -57.39 0.62 Allowed 'General case' 0 C--N 1.346 0.427 0 C-N-CA 127.054 2.142 . . . . 0.0 113.499 174.668 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 6.6 tm-20 -54.64 -49.53 70.34 Favored 'General case' 0 CA--C 1.529 0.158 0 C-N-CA 124.649 1.18 . . . . 0.0 110.416 -177.081 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 13.4 mm100 -56.27 -49.88 72.94 Favored 'General case' 0 C--N 1.341 0.233 0 C-N-CA 123.259 0.623 . . . . 0.0 109.764 -178.231 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 5.3 mpt_? -51.44 -73.82 0.04 OUTLIER 'General case' 0 CA--C 1.515 -0.385 0 C-N-CA 125.12 1.368 . . . . 0.0 110.745 178.023 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 18.3 m-80 -54.24 -38.15 65.42 Favored 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 111.914 0.339 . . . . 0.0 111.914 -170.787 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -61.16 -58.14 9.58 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 123.071 0.549 . . . . 0.0 111.812 175.933 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 14.8 ptpt -67.83 -44.23 77.72 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 118.008 0.367 . . . . 0.0 111.132 -174.679 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 6.3 mm -48.05 -52.04 8.01 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.16 0 C-N-CA 125.686 1.595 . . . . 0.0 109.962 174.148 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 23.0 ttmm -60.91 -48.95 79.44 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 123.804 0.842 . . . . 0.0 111.248 -178.763 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 83.7 p -62.79 -40.88 98.69 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 122.553 0.341 . . . . 0.0 111.849 -178.176 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 61.3 mt -63.3 -44.13 98.98 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.321 0 C-N-CA 124.075 0.95 . . . . 0.0 109.057 175.021 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 33.2 ttm180 -80.88 55.01 2.31 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 125.176 1.391 . . . . 0.0 110.478 179.447 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 23.3 t70 . . . . . 0 CA--C 1.529 0.135 0 C-N-CA 125.58 1.552 . . . . 0.0 108.666 175.341 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 72.7 mt-30 . . . . . 0 CA--C 1.528 0.125 0 N-CA-C 111.97 0.359 . . . . 0.0 111.97 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -52.72 -48.97 66.3 Favored 'General case' 0 N--CA 1.456 -0.17 0 C-N-CA 123.058 0.543 . . . . 0.0 109.666 171.582 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 16.2 mmm-85 -67.91 -34.28 76.32 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-O 118.47 -0.776 . . . . 0.0 112.88 175.907 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 28.4 mmt85 -56.58 -51.7 67.64 Favored 'General case' 0 C--N 1.341 0.236 0 CA-C-N 119.175 0.898 . . . . 0.0 109.705 175.166 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 11.0 m-85 -56.47 -52.19 65.62 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 123.814 0.845 . . . . 0.0 110.918 173.419 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 31.6 t80 -78.97 60.91 3.03 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.485 1.114 . . . . 0.0 109.883 -179.529 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 178.94 -55.03 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 127.339 2.256 . . . . 0.0 107.362 -174.724 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.37 -44.99 96.23 Favored 'General case' 0 C--N 1.34 0.181 0 C-N-CA 124.899 1.279 . . . . 0.0 110.565 175.232 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 89.4 mt -58.33 -47.43 83.76 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 123.118 0.567 . . . . 0.0 109.844 172.343 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 22.5 m-70 -86.37 54.96 3.34 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 124.412 1.085 . . . . 0.0 110.331 -176.535 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 10.6 t0 -124.99 85.18 58.14 Favored Pre-proline 0 CA--C 1.535 0.373 0 C-N-CA 124.425 1.09 . . . . 0.0 109.382 -175.93 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -82.14 59.4 7.02 Favored 'Trans proline' 0 N--CA 1.456 -0.71 0 C-N-CA 123.856 3.037 . . . . 0.0 109.887 179.626 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -155.72 -58.62 0.1 Allowed 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 124.586 1.154 . . . . 0.0 108.981 179.286 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 91.2 mt -70.78 144.16 50.96 Favored 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 174.699 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 29.8 p-10 -79.51 174.66 11.35 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-O 121.195 0.521 . . . . 0.0 110.867 179.943 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 35.8 tp10 -60.88 -36.75 80.02 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 123.772 0.829 . . . . 0.0 111.592 -176.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 51.9 mt-10 -59.76 -57.51 12.59 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 123.322 0.649 . . . . 0.0 110.735 179.728 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 37.3 mt-30 -59.59 -47.76 84.31 Favored 'General case' 0 CA--C 1.529 0.148 0 C-N-CA 124.042 0.937 . . . . 0.0 110.787 -178.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 12.1 ttp-105 -52.83 -55.13 25.28 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 124.716 1.206 . . . . 0.0 111.046 176.972 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 6.5 m120 -59.95 -44.91 94.11 Favored 'General case' 0 CA--C 1.529 0.156 0 C-N-CA 122.693 0.397 . . . . 0.0 110.858 179.324 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.19 -51.08 69.34 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 123.991 0.916 . . . . 0.0 111.744 -177.768 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 19.7 ptpt -65.09 -41.41 95.02 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 118.113 0.415 . . . . 0.0 111.302 179.499 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 5.7 mt -60.39 -52.27 63.33 Favored 'Isoleucine or valine' 0 C--N 1.34 0.171 0 CA-C-O 118.755 -0.64 . . . . 0.0 111.176 -179.452 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 15.0 ptmm? -62.09 -37.67 85.95 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 118.856 0.753 . . . . 0.0 111.591 -178.783 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 55.7 m -61.24 -50.51 72.76 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 122.9 0.48 . . . . 0.0 111.014 177.531 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 89.3 mt -60.88 -51.71 70.02 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 C-N-CA 123.89 0.876 . . . . 0.0 110.195 179.194 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 37.7 ttm180 -60.24 -36.29 77.42 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 124.846 1.258 . . . . 0.0 111.624 -177.172 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 35.9 t70 . . . . . 0 N--CA 1.453 -0.284 0 C-N-CA 123.729 0.812 . . . . 0.0 109.293 173.391 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 63.6 tt0 . . . . . 0 N--CA 1.453 -0.314 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -57.75 -38.06 74.73 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.868 1.267 . . . . 0.0 111.617 174.487 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 40.6 tpt85 -67.65 -51.81 45.55 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 123.715 0.806 . . . . 0.0 110.631 -178.768 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 78.2 ttt-85 -57.74 -51.71 68.44 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 125.586 1.554 . . . . 0.0 110.645 176.793 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 13.1 t80 -47.14 -59.74 2.94 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 126.243 1.817 . . . . 0.0 111.513 173.508 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 50.9 t80 -56.09 -49.18 74.56 Favored 'General case' 0 N--CA 1.456 -0.141 0 C-N-CA 124.128 0.971 . . . . 0.0 110.843 -179.42 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -56.77 -54.52 45.31 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 123.442 0.697 . . . . 0.0 110.748 -177.822 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.21 -44.52 97.15 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 123.658 0.783 . . . . 0.0 111.944 -178.349 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 59.8 tp -61.36 -53.2 59.75 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 124.23 1.012 . . . . 0.0 110.993 -179.621 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 19.4 m-70 -76.62 -50.98 12.46 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 123.593 0.757 . . . . 0.0 111.951 -173.694 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 9.5 t0 -67.23 124.29 88.6 Favored Pre-proline 0 CA--C 1.535 0.389 0 CA-C-O 118.87 -0.586 . . . . 0.0 109.668 -174.84 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_endo -76.15 -10.03 19.3 Favored 'Trans proline' 0 N--CA 1.456 -0.707 0 C-N-CA 123.412 2.741 . . . . 0.0 114.355 -171.937 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -62.56 -31.84 72.7 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 114.382 1.253 . . . . 0.0 114.382 -169.981 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 10.6 mp -63.67 146.63 53.44 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 118.555 0.616 . . . . 0.0 110.073 177.153 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 44.0 p-10 -84.62 29.35 0.61 Allowed 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 114.451 1.278 . . . . 0.0 114.451 -169.71 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 76.34 -58.37 0.53 Allowed 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 124.852 1.261 . . . . 0.0 111.384 -174.878 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 5.6 mp0 -56.88 -49.95 73.98 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 123.385 0.674 . . . . 0.0 110.663 -178.732 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 59.7 mt-30 -51.61 -60.0 3.65 Favored 'General case' 0 C--N 1.34 0.17 0 C-N-CA 124.44 1.096 . . . . 0.0 111.084 178.423 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 10.7 ptp85 -63.42 -44.97 93.08 Favored 'General case' 0 C--N 1.342 0.251 0 CA-C-O 119.253 -0.403 . . . . 0.0 110.75 -175.883 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -55.23 -51.86 65.23 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 123.748 0.819 . . . . 0.0 111.094 -178.132 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -53.78 -53.52 51.15 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 123.641 0.777 . . . . 0.0 111.485 -178.475 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 19.9 ptpt -69.8 -36.94 76.08 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-O 118.648 -0.691 . . . . 0.0 112.007 -178.704 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 44.4 mt -59.44 -45.3 93.73 Favored 'Isoleucine or valine' 0 C--N 1.34 0.189 0 CA-C-N 119.1 0.864 . . . . 0.0 110.162 178.855 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 44.2 mmtm -59.29 -43.27 92.57 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 122.49 0.316 . . . . 0.0 110.496 175.639 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 16.0 m -63.75 -42.21 97.89 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.281 0.632 . . . . 0.0 111.714 179.104 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 30.5 mt -61.56 -49.41 84.51 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.195 0 C-N-CA 125.128 1.371 . . . . 0.0 109.228 176.884 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -82.87 51.47 1.92 Allowed 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 124.714 1.206 . . . . 0.0 110.57 -179.679 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 3.9 p30 . . . . . 0 CA--C 1.531 0.233 0 C-N-CA 123.299 0.64 . . . . 0.0 109.792 171.431 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 21.4 tt0 . . . . . 0 CA--C 1.53 0.199 0 N-CA-C 110.221 -0.289 . . . . 0.0 110.221 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 20.1 tt0 -53.81 -37.02 63.11 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 125.286 1.434 . . . . 0.0 111.508 176.47 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 13.4 mmp_? -70.78 -51.29 27.92 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 118.883 0.765 . . . . 0.0 111.64 178.832 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.42 -50.38 67.73 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 118.897 0.772 . . . . 0.0 109.996 176.973 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 78.1 t80 -50.32 -55.88 13.63 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 126.941 2.096 . . . . 0.0 112.081 174.172 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 49.4 t80 -58.82 -48.66 80.52 Favored 'General case' 0 C--N 1.339 0.14 0 C-N-CA 124.6 1.16 . . . . 0.0 110.927 -178.298 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -54.91 -54.67 39.64 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 123.494 0.717 . . . . 0.0 109.806 178.985 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -56.68 -49.08 76.16 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 122.616 0.366 . . . . 0.0 111.904 -179.671 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 54.4 tp -58.43 -53.67 55.68 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 124.084 0.954 . . . . 0.0 111.333 -178.837 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 19.4 m-70 -77.39 -45.77 24.86 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.783 0.833 . . . . 0.0 112.648 -171.489 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 80.0 m-20 -62.9 130.7 94.19 Favored Pre-proline 0 CA--C 1.537 0.456 0 CA-C-N 118.215 0.462 . . . . 0.0 110.647 -171.254 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -70.77 -29.28 19.3 Favored 'Trans proline' 0 N--CA 1.457 -0.634 0 C-N-CA 123.973 3.115 . . . . 0.0 113.562 -169.755 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 9.8 p-10 -58.76 -27.99 65.48 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 118.493 0.588 . . . . 0.0 111.796 -179.863 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -84.08 72.13 10.5 Favored 'General case' 0 C--N 1.342 0.273 0 N-CA-C 106.112 -1.81 . . . . 0.0 106.112 169.442 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 -77.29 58.09 1.58 Allowed 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 125.612 1.565 . . . . 0.0 112.687 -169.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 22.6 tt0 70.76 157.59 0.17 Allowed 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 125.239 1.416 . . . . 0.0 110.63 -176.919 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.3 tp10 73.8 -56.13 0.65 Allowed 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 127.027 2.131 . . . . 0.0 110.811 -175.392 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 50.9 mt-30 -54.86 -61.59 2.21 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 125.31 1.444 . . . . 0.0 110.01 175.632 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 19.4 ptt180 -63.23 -38.88 92.92 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 123.599 0.76 . . . . 0.0 111.76 178.861 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 14.4 m120 -61.0 -45.02 96.5 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 118.387 0.539 . . . . 0.0 111.099 179.924 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -60.12 -47.54 85.48 Favored 'General case' 0 CA--C 1.529 0.165 0 C-N-CA 123.564 0.745 . . . . 0.0 110.439 176.639 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 30.6 tttt -55.32 -51.17 67.59 Favored 'General case' 0 N--CA 1.448 -0.541 0 C-N-CA 123.441 0.697 . . . . 0.0 111.396 175.748 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 58.2 mt -58.39 -44.73 89.2 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.205 0 C-N-CA 124.269 1.028 . . . . 0.0 110.293 -179.361 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 27.2 ttpp -58.77 -46.95 86.32 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 123.488 0.715 . . . . 0.0 111.251 177.071 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 88.9 p -68.22 -37.87 81.3 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 118.438 0.563 . . . . 0.0 111.94 -179.705 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 68.8 mt -64.82 -60.7 2.34 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.188 0 C-N-CA 123.907 0.883 . . . . 0.0 110.149 179.238 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 17.7 ptp180 -133.66 70.38 1.46 Allowed 'General case' 0 N--CA 1.456 -0.133 0 C-N-CA 123.99 0.916 . . . . 0.0 109.734 -173.215 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 25.3 t70 . . . . . 0 CA--C 1.531 0.221 0 C-N-CA 124.363 1.065 . . . . 0.0 111.556 177.968 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.54 0.582 0 CA-C-O 121.941 0.877 . . . . 0.0 109.969 . . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? -165.17 -52.78 0.03 OUTLIER 'General case' 0 CA--C 1.523 -0.075 0 C-N-CA 126.777 2.031 . . . . 0.0 106.465 -178.947 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 6.1 tmm_? -50.78 -48.56 59.35 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 125.435 1.494 . . . . 0.0 109.874 171.961 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 19.2 ptp180 -63.87 -45.24 90.34 Favored 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 112.582 0.586 . . . . 0.0 112.582 -179.01 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 60.8 m-85 -64.11 -47.42 80.07 Favored 'General case' 0 C--N 1.339 0.139 0 C-N-CA 122.66 0.384 . . . . 0.0 110.386 -179.66 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 64.1 t80 -56.64 -46.82 80.77 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 123.902 0.881 . . . . 0.0 110.495 175.236 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 12.9 tp10 -58.77 -58.47 8.46 Favored 'General case' 0 N--CA 1.455 -0.225 0 C-N-CA 122.949 0.5 . . . . 0.0 110.027 -179.228 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -52.93 -47.24 68.17 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 124.648 1.179 . . . . 0.0 111.588 -179.982 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 63.7 tp -60.14 -49.93 75.69 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.095 0.958 . . . . 0.0 110.612 178.221 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 17.1 m-70 -85.46 54.76 3.23 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.135 0.974 . . . . 0.0 110.453 -178.996 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 73.7 m-20 -135.29 83.49 38.16 Favored Pre-proline 0 CA--C 1.532 0.288 0 C-N-CA 124.698 1.199 . . . . 0.0 108.68 171.482 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_exo -51.99 -42.93 55.72 Favored 'Trans proline' 0 N--CA 1.459 -0.517 0 C-N-CA 124.118 3.212 . . . . 0.0 113.167 175.721 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 50.3 t30 -55.29 -46.66 76.2 Favored 'General case' 0 C--N 1.341 0.21 0 C-N-CA 124.6 1.16 . . . . 0.0 111.651 -178.611 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -73.04 108.81 6.14 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 106.734 -1.58 . . . . 0.0 106.734 173.346 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 1.9 p30 -64.79 170.14 4.47 Favored 'General case' 0 CA--C 1.531 0.218 0 N-CA-C 111.538 0.199 . . . . 0.0 111.538 -172.389 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -47.05 -41.73 17.27 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 124.659 1.184 . . . . 0.0 112.683 -177.093 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 14.3 tp10 -60.83 -58.47 8.31 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 118.354 0.525 . . . . 0.0 110.976 179.503 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 71.9 mt-30 -58.15 -50.55 73.11 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 124.211 1.004 . . . . 0.0 110.806 -178.507 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 17.9 ttp180 -56.83 -55.17 37.83 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 125.594 1.558 . . . . 0.0 110.999 -179.813 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 -60.04 -42.2 93.92 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 122.806 0.443 . . . . 0.0 111.109 179.474 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.96 -43.34 91.27 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 123.196 0.599 . . . . 0.0 111.167 177.509 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 25.8 mmtp -58.5 -58.46 8.42 Favored 'General case' 0 C--N 1.341 0.229 0 C-N-CA 122.875 0.47 . . . . 0.0 110.181 174.883 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 30.3 mm -48.87 -51.77 11.32 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 C-N-CA 123.623 0.769 . . . . 0.0 110.724 -179.522 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 66.0 tttp -61.41 -54.85 38.21 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 124.303 1.041 . . . . 0.0 111.221 -178.168 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 85.6 p -59.3 -38.67 80.81 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 123.261 0.625 . . . . 0.0 112.141 -175.593 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 71.6 mt -61.04 -55.07 27.19 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 C-N-CA 123.578 0.751 . . . . 0.0 110.442 -179.502 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 19.5 ptp180 -72.05 -49.51 36.08 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 118.155 0.434 . . . . 0.0 111.447 -178.225 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 31.9 t70 . . . . . 0 CA--C 1.53 0.193 0 C-N-CA 124.697 1.199 . . . . 0.0 108.631 177.979 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 20.3 tt0 . . . . . 0 CA--C 1.534 0.333 0 N-CA-C 110.775 -0.083 . . . . 0.0 110.775 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 18.4 tt0 -54.4 -29.76 50.03 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 126.204 1.801 . . . . 0.0 112.021 175.042 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 21.0 mmt85 -70.71 -57.54 4.57 Favored 'General case' 0 C--N 1.341 0.2 0 CA-C-N 118.972 0.806 . . . . 0.0 109.397 177.668 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 79.7 mtt85 -50.58 -47.67 57.86 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 124.215 1.006 . . . . 0.0 110.632 177.76 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 31.2 t80 -48.68 -51.35 28.97 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 126.423 1.889 . . . . 0.0 111.287 173.891 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 18.2 m-30 -68.0 -35.67 78.72 Favored 'General case' 0 C--O 1.225 -0.218 0 C-N-CA 123.233 0.613 . . . . 0.0 111.649 179.142 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -60.55 -25.23 66.0 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 119.803 1.183 . . . . 0.0 111.64 175.813 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -84.45 -49.79 8.34 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 123.234 0.614 . . . . 0.0 111.497 171.727 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 34.4 tp -82.42 -57.47 3.34 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.065 0.946 . . . . 0.0 111.413 -170.295 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 25.0 m170 -77.68 69.63 3.95 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 125.404 1.482 . . . . 0.0 108.778 177.727 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -158.45 158.38 29.56 Favored Pre-proline 0 CA--C 1.534 0.333 0 C-N-CA 124.666 1.186 . . . . 0.0 107.866 -172.157 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -67.5 42.2 0.21 Allowed 'Trans proline' 0 CA--C 1.544 1.01 0 C-N-CA 123.737 2.958 . . . . 0.0 114.219 169.767 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 14.9 t-20 61.16 92.89 0.05 OUTLIER 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 126.955 2.102 . . . . 0.0 112.578 177.777 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 78.2 mt -64.51 162.32 15.59 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 169.729 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 10.0 p30 -54.63 144.41 21.87 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 123.088 0.555 . . . . 0.0 110.646 178.182 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 15.3 mp0 -52.45 -42.18 63.94 Favored 'General case' 0 C--O 1.226 -0.143 0 C-N-CA 124.411 1.084 . . . . 0.0 112.013 -173.932 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.4 tm-20 -56.43 -61.73 2.21 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 122.915 0.486 . . . . 0.0 110.551 -177.757 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 26.9 mm100 -61.2 -51.95 66.86 Favored 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 123.135 0.574 . . . . 0.0 110.916 179.197 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 32.2 ttp-105 -57.19 -61.98 2.08 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 123.693 0.797 . . . . 0.0 110.706 -174.142 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 14.4 t-20 -59.39 -39.7 84.19 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 123.974 0.91 . . . . 0.0 111.174 -175.548 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -57.15 -51.27 70.0 Favored 'General case' 0 C--N 1.342 0.257 0 C-N-CA 122.695 0.398 . . . . 0.0 110.83 176.447 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 59.8 mtpt -59.3 -54.84 42.16 Favored 'General case' 0 C--N 1.341 0.238 0 C-N-CA 123.081 0.552 . . . . 0.0 110.59 177.381 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 14.6 mm -51.14 -49.73 28.0 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.276 0 C-N-CA 124.207 1.003 . . . . 0.0 110.682 -178.384 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 27.7 tptp -73.07 -42.21 63.3 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 123.216 0.606 . . . . 0.0 111.973 -175.445 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 99.1 p -61.97 -34.39 76.05 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 118.647 0.658 . . . . 0.0 111.015 178.873 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 90.7 mt -73.11 -49.47 38.28 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.255 0 C-N-CA 124.518 1.127 . . . . 0.0 109.596 175.682 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 81.5 mtp180 -89.77 61.78 5.52 Favored 'General case' 0 CA--C 1.529 0.165 0 C-N-CA 124.228 1.011 . . . . 0.0 108.822 176.542 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 30.2 t0 . . . . . 0 N--CA 1.453 -0.288 0 C-N-CA 123.817 0.847 . . . . 0.0 109.387 -176.318 . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 20.2 mt-30 . . . . . 0 N--CA 1.449 -0.504 0 N-CA-C 107.394 -1.336 . . . . 0.0 107.394 . . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 17.8 tp60 -149.51 -51.21 0.15 Allowed 'General case' 0 CA--C 1.532 0.25 0 CA-C-O 118.923 -0.561 . . . . 0.0 111.834 -176.663 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -70.11 -79.59 0.06 Allowed 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 118.851 0.751 . . . . 0.0 110.557 -172.874 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -55.88 -26.2 46.01 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 124.522 1.129 . . . . 0.0 112.243 173.688 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 62.2 t80 -67.75 -49.43 62.57 Favored 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 125.202 1.401 . . . . 0.0 110.973 178.94 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 70.4 t80 -58.08 -41.15 82.82 Favored 'General case' 0 C--N 1.34 0.19 0 CA-C-O 119.194 -0.431 . . . . 0.0 110.128 174.31 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 15.3 tp10 -59.23 -57.97 10.67 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 118.356 0.525 . . . . 0.0 110.042 176.68 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -52.68 -46.46 67.27 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 124.672 1.189 . . . . 0.0 112.359 -178.245 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 73.0 mt -62.75 -62.14 1.93 Allowed 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.211 0.604 . . . . 0.0 109.775 175.776 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 19.6 m-70 -84.97 48.82 1.62 Allowed 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.53 1.132 . . . . 0.0 110.711 -177.095 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -77.73 162.13 69.16 Favored Pre-proline 0 CA--C 1.538 0.488 0 N-CA-C 108.394 -0.965 . . . . 0.0 108.394 173.711 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -79.13 65.2 8.88 Favored 'Trans proline' 0 N--CA 1.454 -0.842 0 C-N-CA 124.243 3.295 . . . . 0.0 109.861 179.704 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 31.0 m120 59.25 67.78 0.87 Allowed 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 126.792 2.037 . . . . 0.0 112.768 169.97 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 82.0 mt -67.92 166.42 15.71 Favored 'General case' 0 CA--C 1.532 0.283 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 169.72 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 48.7 p-10 -75.9 26.35 0.11 Allowed 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.851 1.26 . . . . 0.0 113.91 -174.54 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 73.01 -55.61 0.68 Allowed 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 126.03 1.732 . . . . 0.0 111.689 -174.954 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -53.83 -54.53 37.12 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 125.094 1.358 . . . . 0.0 111.303 -177.567 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 42.7 mt-30 -61.22 -45.31 95.09 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 123.686 0.794 . . . . 0.0 111.128 -178.813 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 37.6 ttm105 -56.98 -55.85 29.32 Favored 'General case' 0 C--N 1.34 0.196 0 C-N-CA 122.845 0.458 . . . . 0.0 110.118 177.394 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 47.9 m-20 -54.35 -45.19 72.68 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 123.994 0.918 . . . . 0.0 111.052 -179.865 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.43 -43.97 88.94 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 123.351 0.66 . . . . 0.0 111.302 177.165 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 61.2 mtpt -62.06 -45.15 94.79 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-O 119.079 -0.486 . . . . 0.0 110.91 176.986 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 45.2 mm -57.98 -47.34 86.85 Favored 'Isoleucine or valine' 0 C--N 1.342 0.259 0 CA-C-N 118.851 0.751 . . . . 0.0 110.328 176.183 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 63.0 mttp -58.75 -39.16 80.13 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 123.035 0.534 . . . . 0.0 111.563 177.52 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 40.4 m -63.72 -46.42 85.5 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 122.853 0.461 . . . . 0.0 110.946 177.189 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 74.1 mt -63.14 -42.16 95.52 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 C-N-CA 123.567 0.747 . . . . 0.0 110.2 178.892 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 1.5 mmp_? -59.33 -52.24 66.49 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 124.043 0.937 . . . . 0.0 110.035 176.611 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 37.2 t70 . . . . . 0 CA--C 1.531 0.246 0 C-N-CA 124.361 1.064 . . . . 0.0 109.595 179.535 . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 18.7 tp60 . . . . . 0 N--CA 1.455 -0.186 0 CA-C-O 119.007 -0.52 . . . . 0.0 110.701 . . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 22.6 pt20 -50.48 -35.93 31.35 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.394 1.077 . . . . 0.0 112.653 178.166 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 19.5 tpp85 -71.74 -49.42 39.31 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 124.16 0.984 . . . . 0.0 111.312 -179.522 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 38.6 mtp180 -58.94 -47.49 84.87 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 124.277 1.031 . . . . 0.0 110.078 177.125 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 36.3 t80 -53.25 -55.81 21.55 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 126.694 1.998 . . . . 0.0 110.812 174.577 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 44.7 t80 -54.15 -49.29 69.58 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 123.952 0.901 . . . . 0.0 110.682 177.132 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -56.99 -50.68 71.95 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 123.885 0.874 . . . . 0.0 110.937 -177.404 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.71 -53.03 53.65 Favored 'General case' 0 C--N 1.34 0.17 0 CA-C-O 119.413 -0.327 . . . . 0.0 110.781 178.911 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 9.2 tt -51.13 -45.12 61.52 Favored 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 125.46 1.504 . . . . 0.0 111.175 -178.087 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 15.4 m-70 -75.93 71.51 2.74 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 124.032 0.933 . . . . 0.0 109.562 175.78 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -153.48 141.57 13.9 Favored Pre-proline 0 N--CA 1.453 -0.277 0 C-N-CA 126.464 1.906 . . . . 0.0 106.833 178.191 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_endo -79.77 60.04 7.66 Favored 'Trans proline' 0 N--CA 1.457 -0.655 0 C-N-CA 123.535 2.823 . . . . 0.0 110.359 179.204 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 2.2 t30 66.26 107.09 0.04 OUTLIER 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 127.198 2.199 . . . . 0.0 111.351 177.283 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 75.9 mt -57.12 -65.78 0.56 Allowed 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 123.889 0.876 . . . . 0.0 109.645 178.258 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 43.7 p-10 -159.09 21.39 0.2 Allowed 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 124.199 1.0 . . . . 0.0 111.298 171.912 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 73.8 -52.66 0.69 Allowed 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 126.408 1.883 . . . . 0.0 111.535 -176.986 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -55.4 -68.34 0.2 Allowed 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.944 1.298 . . . . 0.0 110.66 177.958 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 99.9 mm-40 -63.04 -38.56 91.68 Favored 'General case' 0 N--CA 1.457 -0.112 0 C-N-CA 124.2 1.0 . . . . 0.0 110.856 -177.6 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -49.38 -66.3 0.42 Allowed 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 125.044 1.338 . . . . 0.0 110.415 174.239 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 14.4 m-80 -65.43 -38.55 90.24 Favored 'General case' 0 CA--C 1.527 0.082 0 CA-C-O 119.188 -0.434 . . . . 0.0 111.173 -176.668 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -54.36 -47.11 72.97 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 122.931 0.493 . . . . 0.0 111.004 177.78 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 60.1 mttp -59.11 -59.62 5.17 Favored 'General case' 0 C--N 1.342 0.245 0 N-CA-C 109.922 -0.399 . . . . 0.0 109.922 176.602 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 28.4 mm -50.52 -47.07 27.58 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.433 0 C-N-CA 123.794 0.838 . . . . 0.0 111.428 -175.76 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -66.78 -53.4 33.35 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 123.658 0.783 . . . . 0.0 111.607 -179.111 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 89.2 p -60.44 -41.15 93.47 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 123.082 0.553 . . . . 0.0 112.073 -176.738 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 68.0 mt -57.44 -44.42 84.52 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.18 0 C-N-CA 124.759 1.224 . . . . 0.0 110.259 176.073 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 73.6 mtm180 -79.98 57.21 2.57 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 123.273 0.629 . . . . 0.0 110.942 177.255 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 24.9 p-10 . . . . . 0 CA--C 1.532 0.284 0 C-N-CA 125.009 1.324 . . . . 0.0 109.764 171.094 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.733 0 N-CA-C 111.19 0.07 . . . . 0.0 111.19 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 3.8 t 57.97 59.26 0.25 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 C-N-CA 125.498 1.519 . . . . 0.0 110.446 -178.842 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -91.22 148.28 22.46 Favored 'General case' 0 C--N 1.339 0.11 0 C-N-CA 123.034 0.534 . . . . 0.0 109.98 176.704 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 16.3 pt20 -78.03 8.71 4.39 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.386 0.674 . . . . 0.0 112.684 176.401 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 45.2 t -155.4 71.43 0.77 Allowed 'General case' 0 C--N 1.342 0.255 0 C-N-CA 124.914 1.285 . . . . 0.0 107.994 172.853 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 33.5 p90 -75.69 32.44 0.11 Allowed 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 125.506 1.523 . . . . 0.0 114.664 -169.874 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 36.4 m-80 -130.3 -51.74 1.1 Allowed 'General case' 0 C--N 1.332 -0.182 0 C-N-CA 125.439 1.496 . . . . 0.0 108.464 175.063 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 58.3 mtt -72.11 -48.47 43.63 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 123.192 0.597 . . . . 0.0 110.103 175.201 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 18.6 tp60 -75.16 -58.02 3.54 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 178.629 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 34.7 mt-30 -87.11 108.71 19.01 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 -178.412 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -151.08 -49.03 0.12 Allowed 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 125.221 1.408 . . . . 0.0 110.28 178.869 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 15.6 tpt180 -58.85 -36.91 75.35 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 123.124 0.57 . . . . 0.0 111.376 176.516 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -62.13 -49.28 76.51 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 123.065 0.546 . . . . 0.0 110.289 -179.685 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 85.8 m-85 -60.24 -46.09 90.99 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 123.263 0.625 . . . . 0.0 110.991 177.565 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 46.9 t80 -54.96 -48.3 73.37 Favored 'General case' 0 C--N 1.341 0.197 0 C-N-CA 122.934 0.494 . . . . 0.0 110.699 175.475 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -63.48 -46.66 85.17 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 122.709 0.404 . . . . 0.0 110.553 -176.598 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.04 -39.81 95.85 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 124.002 0.921 . . . . 0.0 111.824 178.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 66.9 tp -69.02 -48.6 62.56 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 123.515 0.726 . . . . 0.0 110.238 179.148 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 17.3 m-70 -81.84 61.77 5.34 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.292 1.037 . . . . 0.0 109.164 177.631 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 62.1 t0 -146.63 82.62 8.65 Favored Pre-proline 0 CA--C 1.533 0.319 0 C-N-CA 124.886 1.274 . . . . 0.0 108.022 179.33 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -69.09 -25.18 31.94 Favored 'Trans proline' 0 N--CA 1.455 -0.748 0 C-N-CA 123.093 2.529 . . . . 0.0 112.082 -177.346 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 17.8 m-80 -54.28 -48.97 70.65 Favored 'General case' 0 C--N 1.342 0.246 0 C-N-CA 124.248 1.019 . . . . 0.0 109.937 177.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -72.24 118.71 15.46 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 107.145 -1.428 . . . . 0.0 107.145 170.124 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 7.0 p-10 -66.68 160.37 25.72 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 123.504 0.722 . . . . 0.0 110.475 178.016 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -75.18 72.6 2.28 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.103 0.961 . . . . 0.0 111.115 -175.252 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.3 tp10 -171.62 -51.22 0.02 OUTLIER 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 127.139 2.175 . . . . 0.0 106.992 175.344 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 36.1 mm-40 -71.15 -45.48 63.45 Favored 'General case' 0 CA--C 1.53 0.184 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 170.51 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 27.6 ttm180 -52.46 -49.12 65.3 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 124.645 1.178 . . . . 0.0 109.926 170.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 50.7 t30 -61.42 -42.31 98.54 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.557 0.743 . . . . 0.0 110.783 178.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.67 -40.76 88.83 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 122.883 0.473 . . . . 0.0 111.425 177.218 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 62.6 mtpt -59.22 -47.33 85.75 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 118.375 0.534 . . . . 0.0 110.722 175.478 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 33.1 mm -56.78 -53.21 44.94 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.267 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 176.258 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 58.9 mttp -79.3 55.01 1.8 Allowed 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 125.308 1.443 . . . . 0.0 110.376 177.526 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 44.5 t -165.98 -48.63 0.03 OUTLIER 'General case' 0 N--CA 1.456 -0.155 0 C-N-CA 125.625 1.57 . . . . 0.0 108.178 -179.56 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 72.2 mt -54.79 -43.57 67.7 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 171.273 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 13.3 ptp180 -73.33 -49.38 27.74 Favored 'General case' 0 C--N 1.342 0.277 0 CA-C-N 117.982 0.355 . . . . 0.0 111.411 171.243 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -86.63 76.81 9.48 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 124.016 0.926 . . . . 0.0 110.002 -173.616 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 40.9 p-10 . . . . . 0 C--O 1.25 1.092 0 CA-C-O 116.764 -1.589 . . . . 0.0 110.941 179.486 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 0.706 0 N-CA-C 111.641 0.237 . . . . 0.0 111.641 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 13.4 p -75.49 137.88 22.0 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.188 0 C-N-CA 123.365 0.666 . . . . 0.0 109.449 177.048 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -62.14 123.64 18.7 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 123.453 0.701 . . . . 0.0 110.302 -179.598 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 30.5 tp60 -74.65 98.68 3.47 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 108.219 -1.03 . . . . 0.0 108.219 177.89 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 33.3 t -152.1 75.4 1.13 Allowed 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 123.936 0.894 . . . . 0.0 109.846 -174.111 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 15.7 m-30 -83.99 55.53 3.33 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 172.032 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 27.6 m-20 -0.8 -90.96 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 129.57 3.148 . . . . 0.0 114.933 -170.815 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 4.2 mpp? -60.59 -50.1 74.89 Favored 'General case' 0 CA--C 1.529 0.15 0 C-N-CA 123.717 0.807 . . . . 0.0 111.087 -172.695 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 31.0 mm-40 -56.13 -49.19 74.61 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 123.423 0.689 . . . . 0.0 110.429 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 37.0 tt0 -64.97 -39.39 93.41 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 124.654 1.182 . . . . 0.0 111.605 -177.242 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 -57.61 -42.29 82.97 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 123.403 0.681 . . . . 0.0 110.173 172.76 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 6.4 mmp_? -65.91 -32.19 73.55 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-O 118.834 -0.603 . . . . 0.0 112.16 175.267 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 16.7 mmm180 -65.1 -47.59 76.65 Favored 'General case' 0 C--N 1.341 0.232 0 CA-C-N 119.09 0.859 . . . . 0.0 110.836 175.606 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 47.7 m-85 -59.4 -56.11 26.21 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 122.668 0.387 . . . . 0.0 110.751 175.575 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 70.8 t80 -48.03 -52.28 20.66 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 125.626 1.57 . . . . 0.0 110.8 179.138 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 4.4 tm-20 -53.57 -57.9 9.1 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.826 1.25 . . . . 0.0 110.409 175.91 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -53.49 -44.04 68.7 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 124.006 0.922 . . . . 0.0 112.435 -177.866 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 7.1 mp -61.35 -54.32 45.28 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 124.102 0.961 . . . . 0.0 111.283 179.519 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 32.5 m-70 -76.55 -48.14 20.32 Favored 'General case' 0 N--CA 1.457 -0.124 0 N-CA-C 113.046 0.758 . . . . 0.0 113.046 -169.908 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -54.78 113.92 6.1 Favored Pre-proline 0 CA--C 1.535 0.392 0 C-N-CA 124.238 1.015 . . . . 0.0 111.709 -174.288 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -54.95 -40.87 83.59 Favored 'Trans proline' 0 C--N 1.348 0.525 0 C-N-CA 123.481 2.787 . . . . 0.0 112.177 174.34 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 5.0 p30 -57.08 -36.36 70.48 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 123.95 0.9 . . . . 0.0 111.443 177.688 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -80.09 70.74 6.75 Favored 'General case' 0 C--N 1.343 0.31 0 N-CA-C 106.723 -1.584 . . . . 0.0 106.723 169.305 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 8.5 p30 -65.95 168.53 8.0 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 125.208 1.403 . . . . 0.0 110.368 177.415 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -34.59 -64.01 0.27 Allowed 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 126.108 1.763 . . . . 0.0 114.38 -169.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -60.6 -38.64 85.33 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 -176.736 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 25.4 mm100 -70.24 -41.26 73.79 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 123.43 0.692 . . . . 0.0 110.807 179.421 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 64.4 ttp85 -60.47 -45.52 93.43 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 124.388 1.075 . . . . 0.0 110.09 175.538 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 4.6 m-80 -62.06 -40.2 94.98 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 122.885 0.474 . . . . 0.0 110.796 175.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -62.04 -44.16 97.29 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 118.228 0.467 . . . . 0.0 111.349 176.292 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 10.5 mmmm -57.15 -55.87 29.1 Favored 'General case' 0 C--N 1.342 0.273 0 C-N-CA 123.074 0.549 . . . . 0.0 109.909 174.401 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 75.2 mt -52.66 -48.84 47.75 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.298 0 C-N-CA 123.714 0.806 . . . . 0.0 110.837 -179.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 66.5 tttm -60.99 -49.86 75.72 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 123.925 0.89 . . . . 0.0 111.296 -178.728 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 78.6 p -64.77 -41.04 96.18 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 123.2 0.6 . . . . 0.0 111.741 -178.328 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 72.4 mt -59.47 -45.1 94.01 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 C-N-CA 123.543 0.737 . . . . 0.0 109.326 173.48 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 54.0 ttp180 -78.23 58.82 2.14 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 125.139 1.376 . . . . 0.0 109.839 176.813 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -73.58 -50.05 23.2 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 124.237 1.015 . . . . 0.0 110.439 179.645 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 13.2 t70 . . . . . 0 C--O 1.249 1.059 0 CA-C-O 117.362 -1.304 . . . . 0.0 108.485 -177.525 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 0.682 0 N-CA-C 111.661 0.245 . . . . 0.0 111.661 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 73.8 t -67.95 128.47 31.35 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.228 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 -179.664 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -74.66 77.11 2.03 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 124.502 1.121 . . . . 0.0 111.413 -174.144 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 30.5 mt-30 -131.72 -79.3 0.51 Allowed 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 125.499 1.519 . . . . 0.0 108.094 176.287 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 58.3 m -152.49 65.64 0.82 Allowed 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 125.171 1.388 . . . . 0.0 107.466 177.146 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 44.1 p90 -94.8 -14.38 24.72 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 124.488 1.115 . . . . 0.0 113.121 -173.866 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 37.4 t30 -102.71 -87.34 0.42 Allowed 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 123.621 0.768 . . . . 0.0 110.354 -173.424 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 14.1 tpt -85.17 64.41 8.66 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 123.72 0.808 . . . . 0.0 109.522 -174.233 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 9.0 tp-100 -173.17 -61.15 0.02 OUTLIER 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 126.023 1.729 . . . . 0.0 106.631 -177.878 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -85.86 84.48 7.54 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 108.032 -1.099 . . . . 0.0 108.032 173.353 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 15.3 tp60 -154.45 -58.86 0.11 Allowed 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 108.075 -1.083 . . . . 0.0 108.075 179.457 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 3.4 tpm_? -60.66 -45.31 94.6 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 170.105 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 94.8 mtt-85 -54.8 -52.24 63.26 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 124.745 1.218 . . . . 0.0 110.639 177.129 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 21.1 m-85 -59.2 -44.03 92.24 Favored 'General case' 0 C--N 1.34 0.183 0 CA-C-O 119.085 -0.483 . . . . 0.0 111.426 177.789 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 49.3 t80 -59.66 -51.62 69.0 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 118.468 0.576 . . . . 0.0 110.578 178.797 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -55.89 -42.83 76.54 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 123.563 0.745 . . . . 0.0 110.998 179.409 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.77 -57.52 9.69 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.268 0.627 . . . . 0.0 111.576 178.512 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 72.6 mt -60.08 -53.64 55.35 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 124.467 1.107 . . . . 0.0 111.401 -176.481 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 36.6 m-70 -82.64 64.35 7.23 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.156 0.982 . . . . 0.0 109.217 -177.148 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 36.9 t0 -134.32 87.18 33.77 Favored Pre-proline 0 CA--C 1.533 0.301 0 C-N-CA 125.31 1.444 . . . . 0.0 107.949 179.77 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 96.1 Cg_exo -48.01 -43.59 29.89 Favored 'Trans proline' 0 N--CA 1.459 -0.555 0 C-N-CA 124.757 3.638 . . . . 0.0 113.885 -179.12 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 20.3 m120 -60.47 -48.84 80.0 Favored 'General case' 0 CA--C 1.529 0.141 0 C-N-CA 124.04 0.936 . . . . 0.0 111.442 -176.897 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 10.4 mp -75.57 133.28 40.99 Favored 'General case' 0 N--CA 1.456 -0.172 0 C-N-CA 122.938 0.495 . . . . 0.0 109.961 -179.162 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 20.5 p30 -79.41 177.26 8.99 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.517 0.727 . . . . 0.0 111.047 178.414 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -51.55 -48.4 63.09 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 124.432 1.093 . . . . 0.0 112.271 -178.026 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 13.8 tp10 -64.86 -42.87 94.5 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 122.933 0.493 . . . . 0.0 111.173 -178.078 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 65.9 mt-30 -62.36 -41.76 98.86 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 122.863 0.465 . . . . 0.0 110.837 177.735 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 95.5 mtt180 -60.3 -50.73 72.49 Favored 'General case' 0 C--O 1.225 -0.192 0 C-N-CA 122.887 0.475 . . . . 0.0 109.897 174.529 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 78.9 m-20 -53.25 -45.13 68.67 Favored 'General case' 0 C--N 1.341 0.208 0 C-N-CA 123.598 0.759 . . . . 0.0 111.088 178.216 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.75 -43.31 90.25 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 123.559 0.743 . . . . 0.0 111.108 176.734 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 79.2 mttt -59.36 -49.77 76.53 Favored 'General case' 0 C--N 1.341 0.235 0 CA-C-O 118.231 -0.89 . . . . 0.0 111.077 173.359 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 8.3 mm -56.73 -47.58 82.34 Favored 'Isoleucine or valine' 0 C--N 1.343 0.303 0 CA-C-N 119.418 1.008 . . . . 0.0 109.738 -178.337 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 27.3 ttpp -56.63 -45.74 81.37 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.255 1.022 . . . . 0.0 111.63 177.876 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 23.1 t -62.3 -47.44 84.28 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 123.298 0.639 . . . . 0.0 111.009 178.703 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 60.3 mt -60.82 -38.31 78.67 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 C-N-CA 125.005 1.322 . . . . 0.0 110.158 178.72 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 2.4 mmp_? -65.45 -1.04 2.21 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 124.999 1.319 . . . . 0.0 114.345 178.241 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -54.73 -49.35 71.0 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 123.458 0.703 . . . . 0.0 111.518 173.178 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 . . . . . 0 C--O 1.25 1.087 0 CA-C-O 117.539 -1.219 . . . . 0.0 111.013 -179.593 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.78 0 N-CA-C 111.686 0.254 . . . . 0.0 111.686 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 27.4 t -80.01 78.99 1.0 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.239 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 179.372 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -59.03 -40.54 85.35 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 124.211 1.005 . . . . 0.0 111.055 176.22 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 10.6 pt20 -154.42 179.34 9.1 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 124.387 1.075 . . . . 0.0 109.491 176.518 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 7.4 p -78.57 110.36 13.6 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 105.34 -2.096 . . . . 0.0 105.34 169.546 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 51.3 m-85 -79.14 76.59 5.66 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 123.806 0.843 . . . . 0.0 109.876 -171.277 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 42.6 p-10 -43.37 -43.09 4.93 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 126.062 1.745 . . . . 0.0 114.327 179.691 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 28.1 ttt -61.66 -53.57 54.4 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.722 0.809 . . . . 0.0 111.023 179.493 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 26.4 tt0 -62.08 -48.48 80.02 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.315 1.046 . . . . 0.0 110.396 179.219 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 35.8 mt-30 -86.71 20.29 2.6 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 125.95 1.7 . . . . 0.0 111.55 -175.696 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 20.8 tm0? -53.72 -36.97 62.84 Favored 'General case' 0 C--N 1.343 0.314 0 C-N-CA 124.46 1.104 . . . . 0.0 110.131 174.795 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 3.3 mpt_? -63.35 -54.91 29.45 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 123.897 0.879 . . . . 0.0 109.739 179.334 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 19.7 mmm180 -58.58 -47.92 82.67 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 124.04 0.936 . . . . 0.0 110.284 -178.257 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 26.8 t80 -54.55 -48.76 71.65 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 127.367 2.267 . . . . 0.0 111.646 175.874 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 79.7 t80 -65.0 -45.2 86.57 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 124.886 1.274 . . . . 0.0 110.967 -179.573 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -56.46 -51.95 66.51 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.339 0.656 . . . . 0.0 110.081 174.661 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.05 -41.44 87.9 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 124.102 0.961 . . . . 0.0 111.68 179.413 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 49.9 tp -58.56 -46.1 87.58 Favored 'General case' 0 C--N 1.339 0.14 0 C-N-CA 123.759 0.823 . . . . 0.0 110.137 177.643 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 23.0 m-70 -96.67 55.08 1.37 Allowed 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 123.981 0.912 . . . . 0.0 110.148 -178.415 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -142.28 89.17 8.67 Favored Pre-proline 0 CA--C 1.533 0.302 0 C-N-CA 123.816 0.846 . . . . 0.0 109.656 179.346 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_exo -53.48 -30.2 52.8 Favored 'Trans proline' 0 N--CA 1.458 -0.56 0 C-N-CA 124.397 3.398 . . . . 0.0 113.84 175.846 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 11.9 m120 -52.81 -47.71 67.45 Favored 'General case' 0 C--N 1.343 0.316 0 C-N-CA 124.294 1.038 . . . . 0.0 110.707 179.52 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 46.4 mt -69.14 118.45 12.05 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 107.061 -1.459 . . . . 0.0 107.061 169.555 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 12.7 p30 -61.75 156.57 19.99 Favored 'General case' 0 CA--C 1.529 0.155 0 C-N-CA 123.193 0.597 . . . . 0.0 110.96 -178.382 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 9.6 mp0 -47.78 -50.97 24.1 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 125.181 1.393 . . . . 0.0 111.995 -175.778 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -58.37 -59.99 4.49 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 123.104 0.561 . . . . 0.0 111.028 -175.22 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 29.5 mm100 -62.65 -45.56 92.25 Favored 'General case' 0 CA--C 1.529 0.155 0 C-N-CA 123.23 0.612 . . . . 0.0 111.123 -177.405 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 41.2 ttp180 -56.39 -58.93 5.92 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 123.996 0.918 . . . . 0.0 110.372 179.9 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 62.3 m-20 -62.47 -35.27 78.79 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 123.563 0.745 . . . . 0.0 111.343 -176.752 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -62.52 -48.92 77.42 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 122.811 0.444 . . . . 0.0 110.868 175.232 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 59.6 mtpt -59.97 -46.82 88.18 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 123.603 0.761 . . . . 0.0 110.823 178.579 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 24.9 mm -54.41 -57.45 6.18 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.261 0 C-N-CA 123.708 0.803 . . . . 0.0 109.658 174.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 82.0 tttt -80.47 59.2 3.42 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.598 1.159 . . . . 0.0 109.787 178.66 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 46.5 t -168.86 -46.32 0.02 OUTLIER 'General case' 0 N--CA 1.456 -0.174 0 C-N-CA 126.507 1.923 . . . . 0.0 107.929 179.824 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 53.2 mt -53.12 -54.21 18.49 Favored 'Isoleucine or valine' 0 C--N 1.342 0.277 0 C-N-CA 123.717 0.807 . . . . 0.0 109.075 169.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 9.8 ptp180 -82.28 64.4 6.92 Favored 'General case' 0 C--N 1.342 0.248 0 CA-C-O 121.069 0.461 . . . . 0.0 111.216 175.749 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -69.11 -40.09 78.55 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 123.474 0.71 . . . . 0.0 109.613 169.816 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 30.3 t70 . . . . . 0 C--O 1.25 1.084 0 C-N-CA 125.348 1.459 . . . . 0.0 107.487 177.732 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.725 0 N-CA-C 111.662 0.245 . . . . 0.0 111.662 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 16.5 m -81.91 59.05 0.17 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.363 0 C-N-CA 124.169 0.987 . . . . 0.0 110.532 -179.549 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -78.34 75.64 4.86 Favored 'General case' 0 N--CA 1.456 -0.171 0 C-N-CA 124.074 0.949 . . . . 0.0 109.247 178.528 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 20.7 tp60 70.15 -62.15 0.44 Allowed 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 127.044 2.138 . . . . 0.0 111.688 -176.302 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 94.3 p -159.2 173.01 17.03 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 123.558 0.743 . . . . 0.0 110.77 178.336 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 40.3 p90 -59.23 -36.44 75.44 Favored 'General case' 0 C--N 1.34 0.19 0 C-N-CA 123.837 0.855 . . . . 0.0 112.807 -173.436 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 11.6 t30 -44.97 -43.44 9.06 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 124.906 1.282 . . . . 0.0 112.445 177.465 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 1.8 mpt? -64.59 -46.26 83.48 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 123.528 0.731 . . . . 0.0 110.428 -176.648 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 28.1 mm-40 -63.34 -40.19 96.62 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 122.951 0.501 . . . . 0.0 110.325 175.481 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 80.5 mt-30 -78.4 3.7 15.06 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 124.363 1.065 . . . . 0.0 113.553 -177.099 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 -51.68 -39.06 57.56 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 120.286 1.403 . . . . 0.0 111.451 175.535 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 25.6 mmm180 -56.32 -65.96 0.52 Allowed 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 124.079 0.952 . . . . 0.0 110.778 175.794 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 58.2 mtp180 -50.5 -43.56 55.67 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 125.234 1.413 . . . . 0.0 111.561 178.812 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 80.9 t80 -61.04 -53.8 52.69 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 126.919 2.087 . . . . 0.0 111.695 -177.239 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -72.02 -32.59 67.29 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 118.468 0.576 . . . . 0.0 111.171 -179.75 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 25.5 mm-40 -61.46 -42.39 98.7 Favored 'General case' 0 CA--C 1.532 0.269 0 O-C-N 121.628 -0.67 . . . . 0.0 110.182 172.763 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.35 -47.93 83.64 Favored 'General case' 0 N--CA 1.456 -0.172 0 C-N-CA 123.198 0.599 . . . . 0.0 110.483 176.191 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 34.1 tp -50.6 -44.47 57.04 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.682 1.193 . . . . 0.0 110.991 175.419 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 28.1 m170 -78.54 -40.21 35.62 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 123.751 0.82 . . . . 0.0 113.188 -174.113 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.31 140.89 94.48 Favored Pre-proline 0 CA--C 1.537 0.446 0 CA-C-N 119.056 0.844 . . . . 0.0 111.36 -170.011 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_endo -78.86 -37.83 0.55 Allowed 'Trans proline' 0 N--CA 1.455 -0.78 0 C-N-CA 123.289 2.659 . . . . 0.0 112.43 -178.032 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 3.4 p-10 -58.14 -40.85 82.37 Favored 'General case' 0 C--N 1.341 0.23 0 N-CA-C 113.798 1.036 . . . . 0.0 113.798 -169.808 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 68.2 mt -70.3 117.91 12.45 Favored 'General case' 0 N--CA 1.455 -0.186 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 173.019 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 32.9 p-10 -73.1 176.65 5.63 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 123.376 0.67 . . . . 0.0 110.73 178.779 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.9 mp0 -81.54 55.82 2.77 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 123.645 0.778 . . . . 0.0 109.953 179.507 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 56.5 mt-10 -147.17 -60.92 0.28 Allowed 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 126.881 2.072 . . . . 0.0 105.958 169.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 37.2 mm-40 -67.81 -44.08 78.14 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 123.892 0.877 . . . . 0.0 110.439 178.709 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 20.1 ttm180 -58.63 -55.96 28.38 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 123.072 0.549 . . . . 0.0 109.634 177.846 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 22.9 m120 -62.07 -37.91 86.82 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-O 119.158 -0.449 . . . . 0.0 111.374 -177.325 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.3 -48.72 80.58 Favored 'General case' 0 C--N 1.341 0.21 0 CA-C-N 118.239 0.472 . . . . 0.0 110.935 175.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 25.0 mmtp -56.73 -56.86 16.13 Favored 'General case' 0 C--N 1.341 0.203 0 C-N-CA 123.127 0.571 . . . . 0.0 110.338 176.421 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 23.1 mm -50.98 -57.74 2.53 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.235 0 C-N-CA 123.948 0.899 . . . . 0.0 110.408 -179.151 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -53.28 -50.38 64.98 Favored 'General case' 0 N--CA 1.456 -0.164 0 C-N-CA 125.065 1.346 . . . . 0.0 111.044 -179.134 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 35.4 t -58.33 -46.26 86.56 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.694 0.798 . . . . 0.0 111.492 -179.09 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 59.6 mt -65.8 -50.13 72.7 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 C-N-CA 123.008 0.523 . . . . 0.0 110.558 -175.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 18.5 ptp180 -66.51 -33.72 76.32 Favored 'General case' 0 C--N 1.342 0.272 0 CA-C-N 118.223 0.465 . . . . 0.0 112.044 179.149 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -76.77 69.17 3.1 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 108.5 -0.926 . . . . 0.0 108.5 171.881 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 11.0 t70 . . . . . 0 C--O 1.25 1.081 0 CA-C-O 117.176 -1.392 . . . . 0.0 110.634 -171.607 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.744 0 N-CA-C 111.783 0.29 . . . . 0.0 111.783 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 14.6 t 58.52 70.25 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.342 0 C-N-CA 125.13 1.372 . . . . 0.0 109.756 -178.584 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -79.52 64.72 4.48 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.109 0.964 . . . . 0.0 109.825 178.551 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 7.2 pt20 -65.3 -33.72 76.65 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 124.69 1.196 . . . . 0.0 112.168 -177.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 48.5 t -55.52 122.98 12.49 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 123.972 0.909 . . . . 0.0 110.043 -179.369 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -77.57 55.93 1.37 Allowed 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 124.409 1.083 . . . . 0.0 108.285 173.191 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -44.7 -49.59 10.4 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 125.939 1.696 . . . . 0.0 114.289 -169.799 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 28.1 ptm -53.68 -34.4 58.57 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 112.575 0.583 . . . . 0.0 112.575 -178.607 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 23.1 mt-30 -81.72 -60.07 2.38 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 124.168 0.987 . . . . 0.0 109.148 170.468 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 17.6 tt0 -71.36 65.31 0.42 Allowed 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 128.315 2.646 . . . . 0.0 110.725 -177.705 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 19.1 tp60 -163.54 -56.91 0.04 OUTLIER 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 124.435 1.094 . . . . 0.0 110.059 179.288 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 30.9 tpt180 -72.39 -77.98 0.09 Allowed 'General case' 0 C--N 1.341 0.227 0 C-N-CA 122.854 0.461 . . . . 0.0 110.895 -172.701 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.77 -26.83 66.03 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 122.672 0.389 . . . . 0.0 111.562 178.733 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 76.3 t80 -61.22 -56.66 18.12 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 126.425 1.89 . . . . 0.0 110.514 175.486 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 55.7 t80 -58.47 -49.64 76.63 Favored 'General case' 0 C--N 1.341 0.207 0 C-N-CA 122.649 0.38 . . . . 0.0 110.215 176.79 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -56.89 -44.73 82.61 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 122.838 0.455 . . . . 0.0 111.451 -177.827 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.95 -53.87 52.76 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 123.589 0.755 . . . . 0.0 111.49 179.719 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 55.1 tp -63.45 -52.67 60.43 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 122.766 0.426 . . . . 0.0 110.554 -178.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 24.8 m-70 -81.43 64.39 6.13 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 124.465 1.106 . . . . 0.0 109.696 -179.084 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -150.82 115.25 3.22 Favored Pre-proline 0 CA--C 1.533 0.302 0 C-N-CA 124.89 1.276 . . . . 0.0 108.181 175.853 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 94.4 Cg_endo -77.82 -25.11 8.01 Favored 'Trans proline' 0 N--CA 1.455 -0.754 0 C-N-CA 123.249 2.633 . . . . 0.0 112.052 -177.85 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 -56.13 -55.18 36.18 Favored 'General case' 0 C--N 1.342 0.265 0 C-N-CA 123.775 0.83 . . . . 0.0 110.619 -178.796 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 91.0 mt -79.41 141.37 36.9 Favored 'General case' 0 N--CA 1.453 -0.28 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 172.64 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 43.8 p-10 -96.68 176.51 5.98 Favored 'General case' 0 C--O 1.233 0.189 0 C-N-CA 124.493 1.117 . . . . 0.0 110.396 179.485 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -79.37 62.4 3.7 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 124.123 0.969 . . . . 0.0 110.453 175.514 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 64.8 mt-10 -148.2 -47.27 0.16 Allowed 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 127.18 2.192 . . . . 0.0 106.794 169.773 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 22.9 mm100 -80.34 -56.65 4.05 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 124.063 0.945 . . . . 0.0 109.71 173.365 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 21.7 ptt180 -68.0 -41.83 81.66 Favored 'General case' 0 C--N 1.341 0.23 0 CA-C-O 119.526 -0.273 . . . . 0.0 111.151 -173.722 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 43.2 p-10 -62.93 -35.81 81.32 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 117.951 0.341 . . . . 0.0 111.622 -178.112 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -60.73 -44.81 96.18 Favored 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 123.687 0.795 . . . . 0.0 110.567 175.199 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 57.0 mtmt -61.44 -48.91 79.0 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-O 119.423 -0.322 . . . . 0.0 110.712 175.729 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 27.9 mm -55.93 -45.02 79.86 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 C-N-CA 124.056 0.942 . . . . 0.0 111.326 179.294 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 88.6 mttt -61.5 -47.43 85.68 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 123.704 0.801 . . . . 0.0 110.689 175.425 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 23.1 t -61.92 -43.57 98.57 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 123.915 0.886 . . . . 0.0 112.012 -177.589 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 58.4 mt -61.59 -35.58 68.0 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.222 0 C-N-CA 124.102 0.961 . . . . 0.0 109.905 177.401 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 85.3 mtm180 -78.31 52.59 1.15 Allowed 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.27 0.628 . . . . 0.0 111.479 173.248 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -83.71 -31.46 26.04 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 124.491 1.116 . . . . 0.0 109.445 169.579 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 28.4 t70 . . . . . 0 C--O 1.252 1.202 0 C-N-CA 125.337 1.455 . . . . 0.0 108.124 -179.164 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.744 0 N-CA-C 111.671 0.248 . . . . 0.0 111.671 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 15.6 m -82.33 49.12 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.457 0 C-N-CA 124.401 1.081 . . . . 0.0 111.021 -179.409 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -78.51 107.31 11.07 Favored 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 124.32 1.048 . . . . 0.0 109.371 -179.153 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 16.9 tt0 55.89 50.25 14.35 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 124.58 1.152 . . . . 0.0 110.174 -175.795 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 40.6 t -94.77 170.56 9.36 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 124.919 1.288 . . . . 0.0 109.314 177.826 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 69.3 m-85 -75.1 70.42 2.07 Favored 'General case' 0 C--N 1.34 0.181 0 C-N-CA 124.649 1.179 . . . . 0.0 110.988 -177.305 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 4.3 p-10 -179.19 -40.71 0.01 OUTLIER 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 128.432 2.693 . . . . 0.0 107.695 -175.007 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 20.6 mmt -76.68 -51.03 12.26 Favored 'General case' 0 C--N 1.341 0.234 0 N-CA-C 107.386 -1.339 . . . . 0.0 107.386 169.41 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 49.6 mt-30 -54.56 -47.44 73.24 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 124.602 1.161 . . . . 0.0 109.769 172.341 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 26.8 mt-30 -89.8 18.24 5.82 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.304 1.041 . . . . 0.0 112.061 -176.077 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 11.9 tp-100 -66.38 -46.08 77.87 Favored 'General case' 0 C--N 1.341 0.23 0 CA-C-N 118.944 0.793 . . . . 0.0 110.042 179.638 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 9.1 mmm180 -58.4 -36.59 73.79 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.785 0.834 . . . . 0.0 111.426 173.042 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 12.0 mmp_? -68.52 -37.22 79.84 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 123.581 0.753 . . . . 0.0 110.534 179.634 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 15.6 m-30 -65.29 -48.86 71.67 Favored 'General case' 0 N--CA 1.455 -0.196 0 CA-C-O 119.428 -0.32 . . . . 0.0 110.157 172.198 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 21.3 m-85 -79.39 60.27 3.12 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 123.904 0.882 . . . . 0.0 109.987 175.716 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.7 tm-20 -175.57 -50.33 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 127.182 2.193 . . . . 0.0 106.99 -174.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -73.8 -53.03 11.18 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 124.179 0.992 . . . . 0.0 110.896 175.856 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 58.5 tp -73.4 -54.89 7.22 Favored 'General case' 0 C--N 1.34 0.166 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 175.157 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 56.0 m-70 -84.01 59.78 5.48 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 123.423 0.689 . . . . 0.0 109.696 178.898 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -94.57 137.62 22.53 Favored Pre-proline 0 CA--C 1.533 0.322 0 C-N-CA 124.439 1.096 . . . . 0.0 108.239 174.531 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_exo -42.43 -52.94 4.01 Favored 'Trans proline' 0 N--CA 1.458 -0.59 0 C-N-CA 124.004 3.136 . . . . 0.0 114.136 173.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 5.9 p-10 -160.31 131.94 5.95 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 123.621 0.768 . . . . 0.0 110.54 -179.573 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 92.8 mt -140.5 -126.95 0.11 Allowed 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 125.4 1.48 . . . . 0.0 107.104 172.704 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 51.6 p-10 -155.07 23.58 0.43 Allowed 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.768 0.827 . . . . 0.0 111.957 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 74.17 -54.28 0.68 Allowed 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 125.91 1.684 . . . . 0.0 112.109 -177.47 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -52.58 -59.64 4.22 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 124.465 1.106 . . . . 0.0 110.24 178.067 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 83.8 mt-30 -58.82 -43.31 90.57 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 124.803 1.241 . . . . 0.0 110.897 178.652 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 59.2 ttm-85 -55.51 -54.98 37.13 Favored 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 124.807 1.243 . . . . 0.0 111.218 -177.502 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 28.8 m-80 -71.23 -38.16 71.99 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 123.061 0.544 . . . . 0.0 111.146 179.804 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.19 -43.74 87.69 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 118.434 0.561 . . . . 0.0 111.233 177.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 58.6 mtpt -59.59 -50.99 71.76 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 123.129 0.571 . . . . 0.0 109.929 175.709 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 11.6 mm -52.99 -51.75 35.23 Favored 'Isoleucine or valine' 0 C--N 1.341 0.226 0 C-N-CA 123.019 0.527 . . . . 0.0 111.045 178.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 67.6 mttm -57.68 -49.63 75.85 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 123.527 0.731 . . . . 0.0 110.878 179.683 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 32.5 t -57.77 -51.29 70.16 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 124.072 0.949 . . . . 0.0 111.472 -179.119 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 67.1 mt -58.97 -58.26 7.66 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.223 0 C-N-CA 124.765 1.226 . . . . 0.0 109.435 179.722 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 61.1 ttm-85 -55.44 -42.28 73.99 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 125.136 1.374 . . . . 0.0 111.39 -175.721 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -77.39 68.56 3.52 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 123.957 0.903 . . . . 0.0 109.249 172.762 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 18.4 t70 . . . . . 0 C--O 1.25 1.124 0 CA-C-O 117.172 -1.394 . . . . 0.0 110.041 -178.696 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.741 0 N-CA-C 111.757 0.28 . . . . 0.0 111.757 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 42.6 t -78.59 84.11 1.03 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 179.335 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -154.55 151.33 28.75 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 124.776 1.231 . . . . 0.0 108.9 178.881 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 42.5 tt0 54.83 46.28 24.83 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 124.568 1.147 . . . . 0.0 110.76 -178.673 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 15.1 t -74.9 -8.47 56.57 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 123.561 0.744 . . . . 0.0 112.888 -176.327 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 47.8 p90 -69.11 -29.53 67.63 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 123.21 0.604 . . . . 0.0 111.096 176.26 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 32.9 m120 -76.72 59.54 1.57 Allowed 'General case' 0 C--N 1.343 0.29 0 C-N-CA 123.882 0.873 . . . . 0.0 110.563 170.344 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 95.1 mtp -143.91 -60.64 0.4 Allowed 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 127.478 2.311 . . . . 0.0 105.868 171.053 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 49.5 mm-40 -60.54 -43.75 96.85 Favored 'General case' 0 C--N 1.341 0.22 0 C-N-CA 124.275 1.03 . . . . 0.0 110.468 170.746 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 17.4 mm100 -56.51 -48.48 77.12 Favored 'General case' 0 C--O 1.225 -0.228 0 CA-C-O 119.092 -0.48 . . . . 0.0 110.747 176.026 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 16.1 mm100 -67.3 -38.64 85.32 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 123.753 0.821 . . . . 0.0 111.447 -177.188 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 4.0 tmt_? -62.84 -54.95 30.93 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 124.432 1.093 . . . . 0.0 110.265 176.531 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 89.4 mtt-85 -67.56 -32.73 73.7 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 124.067 0.947 . . . . 0.0 111.185 -177.144 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 3.5 t80 -56.98 -53.79 54.06 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 125.275 1.43 . . . . 0.0 110.294 169.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 70.9 t80 -57.42 -48.06 80.13 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 123.377 0.671 . . . . 0.0 110.724 179.747 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 73.2 mt-10 -56.13 -50.02 72.28 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 123.119 0.568 . . . . 0.0 111.077 175.791 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -56.81 -45.09 82.49 Favored 'General case' 0 C--N 1.341 0.207 0 C-N-CA 124.138 0.975 . . . . 0.0 111.462 179.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 1.1 tt -50.8 -41.26 57.05 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 124.454 1.102 . . . . 0.0 109.95 175.01 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 11.9 m-70 -100.52 25.64 7.53 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 124.437 1.095 . . . . 0.0 112.678 -176.169 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 80.0 m-20 -69.05 151.98 96.97 Favored Pre-proline 0 CA--C 1.538 0.486 0 CA-C-N 119.13 0.877 . . . . 0.0 109.946 174.884 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_exo -50.75 -63.64 0.27 Allowed 'Trans proline' 0 C--N 1.351 0.663 0 C-N-CA 123.962 3.108 . . . . 0.0 114.46 -173.831 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 -162.96 84.61 0.52 Allowed 'General case' 0 N--CA 1.456 -0.141 0 C-N-CA 123.189 0.596 . . . . 0.0 109.572 -176.077 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 89.6 mt -122.94 129.24 51.33 Favored 'General case' 0 N--CA 1.456 -0.135 0 N-CA-C 106.267 -1.753 . . . . 0.0 106.267 172.747 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 1.7 p30 -69.24 163.93 23.88 Favored 'General case' 0 CA--C 1.529 0.157 0 N-CA-C 112.883 0.697 . . . . 0.0 112.883 -169.533 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 -58.02 -28.52 64.52 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 124.372 1.069 . . . . 0.0 113.074 -172.002 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -57.64 -50.29 73.66 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 119.069 0.849 . . . . 0.0 109.902 173.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 47.5 mt-30 -65.39 -40.13 93.07 Favored 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 124.278 1.031 . . . . 0.0 110.378 -179.885 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 5.8 mmp_? -62.25 -65.0 0.75 Allowed 'General case' 0 C--N 1.342 0.257 0 N-CA-C 109.244 -0.651 . . . . 0.0 109.244 177.896 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 61.2 t30 -50.14 -38.7 40.47 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 124.909 1.284 . . . . 0.0 112.368 -176.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -54.6 -49.25 70.91 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 118.297 0.499 . . . . 0.0 111.103 174.013 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 95.5 mttt -62.54 -55.87 23.35 Favored 'General case' 0 C--N 1.342 0.241 0 CA-C-O 118.938 -0.553 . . . . 0.0 110.807 173.831 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 4.9 mm -57.73 -37.96 62.4 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 CA-C-N 118.294 0.497 . . . . 0.0 110.499 -171.056 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 17.6 tppt? -60.2 -50.98 71.51 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 124.265 1.026 . . . . 0.0 110.453 176.701 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 18.1 m -59.55 -44.96 93.09 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.59 0.756 . . . . 0.0 111.037 179.067 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 48.8 mt -62.69 -47.72 91.57 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 C-N-CA 125.386 1.474 . . . . 0.0 110.226 -179.347 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 78.4 mtm180 -56.91 -46.53 81.92 Favored 'General case' 0 C--N 1.34 0.193 0 C-N-CA 123.77 0.828 . . . . 0.0 110.282 174.325 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 53.0 m-20 -85.67 43.59 1.04 Allowed 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.773 0.829 . . . . 0.0 110.992 -178.846 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 39.1 t70 . . . . . 0 C--O 1.25 1.084 0 CA-C-O 117.013 -1.47 . . . . 0.0 109.145 177.11 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.728 0 CA-C-O 120.01 -0.043 . . . . 0.0 111.046 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 18.9 m -72.34 156.92 6.75 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.228 0 C-N-CA 122.879 0.472 . . . . 0.0 110.979 -178.065 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -71.28 153.04 42.71 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 123.508 0.723 . . . . 0.0 110.977 -179.601 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 55.1 mm-40 53.65 51.33 15.28 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 125.44 1.496 . . . . 0.0 111.296 -179.658 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 30.7 t -151.93 -98.71 0.06 Allowed 'General case' 0 N--CA 1.455 -0.21 0 N-CA-C 108.177 -1.046 . . . . 0.0 108.177 -179.048 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 95.5 m-85 -46.14 -39.79 10.09 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 126.268 1.827 . . . . 0.0 111.251 173.867 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 7.4 m120 -31.46 -48.52 0.14 Allowed 'General case' 0 CA--C 1.529 0.165 0 C-N-CA 128.151 2.58 . . . . 0.0 113.0 170.294 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -59.88 -52.5 65.17 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 123.386 0.674 . . . . 0.0 110.296 -178.667 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 47.9 mm-40 -60.41 -48.31 82.32 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 124.078 0.951 . . . . 0.0 110.592 178.756 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 16.6 mm100 -54.23 -55.83 24.27 Favored 'General case' 0 C--N 1.341 0.21 0 C-N-CA 124.502 1.121 . . . . 0.0 110.557 179.726 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 62.0 mm-40 -59.35 -39.57 83.62 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 124.015 0.926 . . . . 0.0 111.63 179.25 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 9.7 mmm180 -58.95 -56.91 16.11 Favored 'General case' 0 N--CA 1.456 -0.167 0 CA-C-N 118.143 0.428 . . . . 0.0 110.909 176.406 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 19.8 ptt180 -66.07 -30.69 71.25 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 112.557 0.577 . . . . 0.0 112.557 -177.582 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 15.5 m-85 -58.69 -52.01 67.52 Favored 'General case' 0 C--N 1.343 0.311 0 CA-C-N 118.494 0.588 . . . . 0.0 110.344 169.874 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 47.5 t80 -58.37 -48.65 79.94 Favored 'General case' 0 C--N 1.341 0.203 0 C-N-CA 122.994 0.517 . . . . 0.0 110.657 -179.807 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -56.99 -46.99 81.87 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 123.355 0.662 . . . . 0.0 111.03 -179.742 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.62 -54.09 44.82 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 123.402 0.681 . . . . 0.0 111.514 178.716 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 61.3 tp -59.86 -45.77 91.39 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 124.572 1.149 . . . . 0.0 111.215 -176.428 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 22.9 m-70 -89.28 16.24 7.71 Favored 'General case' 0 CA--C 1.537 0.481 0 C-N-CA 124.309 1.043 . . . . 0.0 111.994 -179.617 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -68.22 135.45 91.33 Favored Pre-proline 0 CA--C 1.533 0.311 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 172.863 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -67.67 -29.16 36.61 Favored 'Trans proline' 0 N--CA 1.457 -0.651 0 C-N-CA 122.456 2.104 . . . . 0.0 112.668 -176.39 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 27.5 m-80 -83.1 62.88 6.84 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.685 0.794 . . . . 0.0 110.516 -175.884 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 20.7 mt -80.3 87.1 5.6 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-O 121.683 0.754 . . . . 0.0 110.234 177.794 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 52.3 p-10 -98.7 17.36 19.47 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 125.602 1.561 . . . . 0.0 110.775 171.413 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.9 mp0 71.46 -55.98 0.64 Allowed 'General case' 0 C--N 1.345 0.408 0 C-N-CA 127.223 2.209 . . . . 0.0 111.277 -174.035 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -45.24 -54.03 7.55 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 126.246 1.819 . . . . 0.0 112.219 -178.191 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 37.1 mt-30 -60.52 -54.13 49.15 Favored 'General case' 0 C--N 1.34 0.176 0 C-N-CA 123.301 0.641 . . . . 0.0 110.56 -176.34 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 78.3 ttt180 -54.33 -56.19 20.99 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 124.117 0.967 . . . . 0.0 110.998 -179.253 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 11.4 m-80 -59.74 -50.3 74.38 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 122.939 0.495 . . . . 0.0 110.854 -177.537 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -54.64 -50.21 68.69 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 123.262 0.625 . . . . 0.0 111.409 -179.828 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 27.1 mmmt -61.39 -54.02 49.1 Favored 'General case' 0 N--CA 1.454 -0.225 0 C-N-CA 122.769 0.428 . . . . 0.0 110.83 179.603 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 39.7 mt -54.87 -46.53 75.68 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 C-N-CA 123.282 0.633 . . . . 0.0 110.999 -178.159 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 60.9 mtpt -58.16 -48.25 80.85 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 123.888 0.875 . . . . 0.0 110.972 176.227 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 50.3 m -58.29 -52.7 64.49 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 117.917 0.326 . . . . 0.0 111.121 179.13 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 41.1 mt -63.37 -49.06 84.38 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.251 0 C-N-CA 124.312 1.045 . . . . 0.0 110.751 -173.891 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 12.3 ptm180 -64.81 -34.79 79.2 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 118.018 0.372 . . . . 0.0 111.634 -177.087 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 84.1 m-20 -68.54 -48.62 63.84 Favored 'General case' 0 C--N 1.341 0.237 0 C-N-CA 122.761 0.424 . . . . 0.0 110.235 175.539 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 34.3 t70 . . . . . 0 C--O 1.251 1.178 0 CA-C-O 117.459 -1.258 . . . . 0.0 109.403 178.522 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.762 0 N-CA-C 111.72 0.267 . . . . 0.0 111.72 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 22.8 t -72.24 81.26 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.353 0 C-N-CA 123.831 0.852 . . . . 0.0 109.013 179.467 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -152.02 -67.57 0.17 Allowed 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 124.677 1.191 . . . . 0.0 108.817 -179.738 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.86 58.07 2.75 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.19 0.996 . . . . 0.0 110.838 178.16 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 59.0 m -130.79 54.85 1.87 Allowed 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 107.007 -1.479 . . . . 0.0 107.007 -178.589 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 18.0 m-85 -79.51 69.78 5.84 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 124.931 1.292 . . . . 0.0 108.475 -179.06 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 10.6 m120 -77.84 54.79 1.31 Allowed 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 125.271 1.428 . . . . 0.0 112.706 -169.899 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 62.6 mtt -149.21 -52.75 0.16 Allowed 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 128.726 2.81 . . . . 0.0 105.737 174.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 48.3 mt-30 -64.12 -56.74 12.73 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 125.343 1.457 . . . . 0.0 108.499 169.679 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 90.0 mt-30 -64.39 -20.74 66.33 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 125.537 1.535 . . . . 0.0 112.154 176.617 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 11.5 tt0 -60.23 -32.56 71.24 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 118.876 0.762 . . . . 0.0 111.398 177.254 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 5.1 mmp_? -64.14 -47.02 81.53 Favored 'General case' 0 N--CA 1.456 -0.151 0 C-N-CA 123.245 0.618 . . . . 0.0 110.12 173.858 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 79.4 mtt85 -60.49 -44.33 96.07 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 123.42 0.688 . . . . 0.0 110.139 178.151 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 14.1 m-30 -57.67 -45.71 85.23 Favored 'General case' 0 C--O 1.225 -0.215 0 C-N-CA 123.562 0.745 . . . . 0.0 111.592 174.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 87.0 t80 -58.43 -52.27 66.34 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 118.648 0.658 . . . . 0.0 110.373 178.795 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -56.9 -52.41 65.25 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.564 0.746 . . . . 0.0 111.178 179.841 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.23 -51.13 70.87 Favored 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 124.739 1.216 . . . . 0.0 111.555 -178.004 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 59.6 tp -62.11 -50.2 72.87 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 124.541 1.136 . . . . 0.0 110.34 -177.548 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 18.0 m-70 -82.17 62.78 6.06 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.8 0.84 . . . . 0.0 109.674 178.008 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -154.43 121.93 2.89 Favored Pre-proline 0 CA--C 1.535 0.371 0 C-N-CA 123.916 0.886 . . . . 0.0 109.414 176.491 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo -80.06 -32.75 1.31 Allowed 'Trans proline' 0 N--CA 1.456 -0.735 0 C-N-CA 123.458 2.772 . . . . 0.0 112.319 -178.311 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 30.3 t30 -53.52 -47.88 69.52 Favored 'General case' 0 C--N 1.343 0.298 0 C-N-CA 124.231 1.012 . . . . 0.0 110.923 -176.246 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -75.87 88.51 2.88 Favored 'General case' 0 N--CA 1.455 -0.219 0 N-CA-C 105.272 -2.121 . . . . 0.0 105.272 169.5 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 -81.69 55.45 2.7 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.532 1.133 . . . . 0.0 112.811 -169.639 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 15.3 tt0 69.88 164.94 0.27 Allowed 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.879 1.272 . . . . 0.0 110.969 -179.353 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.9 tp10 71.8 -64.01 0.4 Allowed 'General case' 0 N--CA 1.456 -0.163 0 C-N-CA 127.031 2.132 . . . . 0.0 110.775 -178.033 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 33.4 mm-40 -59.58 -45.39 92.02 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 124.341 1.057 . . . . 0.0 109.631 171.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 39.3 ttp180 -56.13 -53.32 58.51 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 125.684 1.594 . . . . 0.0 110.513 176.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 9.8 m120 -61.81 -43.45 98.82 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 124.467 1.107 . . . . 0.0 110.742 -179.579 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -60.83 -51.23 70.18 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 124.081 0.952 . . . . 0.0 111.206 -178.541 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 61.1 pttt -66.52 -34.9 78.95 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 118.345 0.52 . . . . 0.0 111.594 -178.101 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 5.3 mt -58.95 -48.08 87.67 Favored 'Isoleucine or valine' 0 C--N 1.342 0.251 0 CA-C-O 118.962 -0.542 . . . . 0.0 109.84 170.407 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 52.0 tptt -60.95 -37.32 81.93 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 118.754 0.706 . . . . 0.0 111.435 179.228 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 19.4 m -59.61 -41.63 90.78 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 118.507 0.594 . . . . 0.0 111.188 174.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 70.7 mt -65.61 -60.61 2.44 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.453 0 C-N-CA 123.831 0.852 . . . . 0.0 109.709 177.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 3.5 ptm180 -92.09 69.47 5.31 Favored 'General case' 0 C--N 1.341 0.219 0 C-N-CA 123.783 0.833 . . . . 0.0 110.191 174.197 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -82.1 59.84 4.6 Favored 'General case' 0 CA--C 1.532 0.253 0 N-CA-C 109.91 -0.404 . . . . 0.0 109.91 178.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 . . . . . 0 C--O 1.251 1.15 0 CA-C-O 117.517 -1.23 . . . . 0.0 110.645 -179.092 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 0.718 0 N-CA-C 111.921 0.341 . . . . 0.0 111.921 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 35.3 m -65.39 159.64 3.97 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 C-N-CA 123.603 0.761 . . . . 0.0 110.937 179.033 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -79.39 64.32 4.25 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 124.121 0.968 . . . . 0.0 111.083 -177.269 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 64.1 tp60 -153.52 57.96 0.75 Allowed 'General case' 0 N--CA 1.454 -0.268 0 N-CA-C 107.464 -1.309 . . . . 0.0 107.464 173.308 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 87.3 p -138.11 47.55 2.01 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 124.914 1.286 . . . . 0.0 107.959 -176.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 9.4 m-85 -80.23 67.6 6.11 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 124.81 1.244 . . . . 0.0 108.101 178.58 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 36.5 p-10 -30.7 -56.61 0.21 Allowed 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 126.794 2.038 . . . . 0.0 114.576 -173.325 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 96.4 mtp -80.88 58.74 3.48 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.346 1.058 . . . . 0.0 110.823 179.89 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 23.2 tt0 177.55 -57.9 0.01 OUTLIER 'General case' 0 CA--C 1.529 0.147 0 C-N-CA 127.755 2.422 . . . . 0.0 106.352 -178.259 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 29.1 mm100 -54.08 -34.88 61.32 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 125.218 1.407 . . . . 0.0 112.012 176.686 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -36.42 -41.11 0.27 Allowed 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 125.937 1.695 . . . . 0.0 114.204 177.673 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 33.3 tpt85 -69.97 -53.98 15.33 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.352 0.661 . . . . 0.0 111.075 -178.738 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 9.8 mpt_? -61.47 -47.29 86.37 Favored 'General case' 0 CA--C 1.53 0.212 0 C-N-CA 124.446 1.098 . . . . 0.0 109.577 -178.912 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 88.4 t80 -49.42 -51.64 33.96 Favored 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 127.709 2.403 . . . . 0.0 111.33 172.67 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 40.7 t80 -58.41 -47.41 84.01 Favored 'General case' 0 C--N 1.341 0.197 0 CA-C-O 119.019 -0.515 . . . . 0.0 110.803 177.388 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 46.4 mm-40 -58.43 -51.69 68.75 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 118.68 0.673 . . . . 0.0 110.69 178.909 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -56.45 -45.59 80.76 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 124.374 1.07 . . . . 0.0 111.72 -178.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 57.7 tp -64.87 -53.47 46.11 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 123.9 0.88 . . . . 0.0 110.384 178.506 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 16.8 m-70 -82.28 57.99 3.86 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 124.643 1.177 . . . . 0.0 109.877 -179.782 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -156.51 78.02 4.15 Favored Pre-proline 0 CA--C 1.534 0.356 0 C-N-CA 124.904 1.282 . . . . 0.0 107.79 178.266 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -82.47 59.08 6.78 Favored 'Trans proline' 0 N--CA 1.456 -0.683 0 C-N-CA 124.323 3.349 . . . . 0.0 110.568 -172.659 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 3.1 p-10 -154.47 -30.9 0.11 Allowed 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 124.806 1.242 . . . . 0.0 111.556 -176.372 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -62.83 153.61 32.55 Favored 'General case' 0 C--N 1.343 0.293 0 CA-C-N 118.742 0.701 . . . . 0.0 109.995 170.782 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 8.9 p30 -65.92 132.48 48.73 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 175.247 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -80.76 65.27 5.84 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 124.276 1.03 . . . . 0.0 108.585 -178.295 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.9 tp10 -152.07 -52.59 0.12 Allowed 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 126.805 2.042 . . . . 0.0 106.636 179.515 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 35.0 mt-30 -63.62 -65.45 0.68 Allowed 'General case' 0 C--N 1.341 0.218 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 171.678 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 18.7 ptt180 -61.59 -33.62 74.2 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-O 119.075 -0.488 . . . . 0.0 111.728 178.266 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 24.5 t-20 -63.88 -49.4 72.87 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 118.482 0.583 . . . . 0.0 111.191 179.031 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.34 -47.55 83.42 Favored 'General case' 0 C--N 1.339 0.15 0 C-N-CA 123.552 0.741 . . . . 0.0 110.864 178.159 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 57.8 mtpt -56.36 -61.19 2.57 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 123.51 0.724 . . . . 0.0 110.176 177.266 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 38.5 mt -49.89 -53.0 11.85 Favored 'Isoleucine or valine' 0 C--N 1.338 0.076 0 C-N-CA 124.946 1.298 . . . . 0.0 110.994 -178.843 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 6.9 ttpm? -53.37 -54.05 42.3 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 124.429 1.092 . . . . 0.0 111.311 178.86 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 51.0 m -56.82 -48.12 78.72 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 122.656 0.382 . . . . 0.0 111.647 179.883 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 67.4 mt -62.27 -50.83 78.39 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.267 0 C-N-CA 124.314 1.046 . . . . 0.0 110.697 -175.278 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 36.2 ptt85 -71.93 -31.85 66.77 Favored 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 112.484 0.55 . . . . 0.0 112.484 -177.301 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 87.6 m-20 -69.3 -45.25 70.04 Favored 'General case' 0 C--N 1.341 0.226 0 CA-C-N 118.212 0.46 . . . . 0.0 110.855 178.689 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 . . . . . 0 C--O 1.251 1.161 0 CA-C-O 116.728 -1.606 . . . . 0.0 110.287 -175.691 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 0.689 0 N-CA-C 111.73 0.27 . . . . 0.0 111.73 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 21.9 t -78.49 72.23 0.54 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 C-N-CA 124.104 0.961 . . . . 0.0 108.718 -179.737 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -165.33 -68.26 0.03 OUTLIER 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 125.767 1.627 . . . . 0.0 107.106 178.365 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -83.8 63.48 7.52 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.829 0.852 . . . . 0.0 109.086 171.113 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 23.0 t -136.67 56.74 1.79 Allowed 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 107.346 -1.353 . . . . 0.0 107.346 178.736 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 24.3 m-85 -79.82 70.4 6.35 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 124.895 1.278 . . . . 0.0 108.369 179.323 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -61.84 66.11 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 127.714 2.405 . . . . 0.0 115.247 -169.708 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 37.2 tpp -179.39 -45.88 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 128.638 2.775 . . . . 0.0 107.185 179.22 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 28.3 mp0 -75.74 -43.3 47.48 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 125.757 1.623 . . . . 0.0 109.404 173.206 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 12.5 mm100 -49.65 -41.58 43.07 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 125.654 1.582 . . . . 0.0 111.157 173.712 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 82.2 mt-30 -53.35 -42.49 66.87 Favored 'General case' 0 C--N 1.34 0.182 0 C-N-CA 124.317 1.047 . . . . 0.0 111.337 177.362 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 80.4 mmt-85 -64.26 -42.05 96.65 Favored 'General case' 0 N--CA 1.456 -0.165 0 C-N-CA 123.4 0.68 . . . . 0.0 110.611 -178.16 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.48 -40.25 95.32 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-O 119.546 -0.264 . . . . 0.0 110.54 173.951 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 20.6 m-85 -62.66 -34.07 76.34 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-O 118.716 -0.659 . . . . 0.0 111.496 175.673 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 19.5 m-85 -76.72 55.12 1.03 Allowed 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 119.075 0.852 . . . . 0.0 110.342 172.449 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -178.56 -55.93 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 127.183 2.193 . . . . 0.0 107.676 -179.034 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -80.53 -47.52 14.12 Favored 'General case' 0 C--N 1.34 0.185 0 C-N-CA 123.951 0.9 . . . . 0.0 111.579 -179.366 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.0 tt -78.01 -56.49 4.44 Favored 'General case' 0 C--N 1.338 0.072 0 N-CA-C 107.956 -1.127 . . . . 0.0 107.956 -178.079 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 62.7 m-70 -84.45 54.41 2.99 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 124.422 1.089 . . . . 0.0 109.392 176.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -87.45 141.55 32.46 Favored Pre-proline 0 CA--C 1.533 0.318 0 C-N-CA 123.649 0.779 . . . . 0.0 109.785 -179.818 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_exo -43.52 -59.97 0.9 Allowed 'Trans proline' 0 N--CA 1.455 -0.771 0 C-N-CA 124.212 3.275 . . . . 0.0 115.343 173.015 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 9.4 p30 -157.53 25.91 0.29 Allowed 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 115.001 1.482 . . . . 0.0 115.001 -169.969 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 28.5 mt -63.1 133.24 54.14 Favored 'General case' 0 C--N 1.34 0.182 0 CA-C-N 119.647 1.112 . . . . 0.0 109.375 169.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 14.2 p30 -65.05 163.82 14.05 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 123.715 0.806 . . . . 0.0 110.527 175.847 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -51.48 -49.11 62.46 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 124.05 0.94 . . . . 0.0 112.314 -175.046 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -58.2 -57.23 13.79 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.312 0.645 . . . . 0.0 110.959 -177.331 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 92.0 mm-40 -66.62 -43.47 84.67 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 123.073 0.549 . . . . 0.0 111.495 -175.217 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 22.3 ttm-85 -56.02 -54.55 43.54 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.761 0.824 . . . . 0.0 109.619 175.889 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -57.17 -40.7 77.81 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 123.877 0.871 . . . . 0.0 111.624 178.282 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -60.42 -45.59 93.07 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 123.061 0.544 . . . . 0.0 111.088 178.429 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 12.3 mmmm -58.75 -47.48 84.51 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 122.591 0.356 . . . . 0.0 110.707 175.56 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 48.2 mm -57.15 -44.49 83.42 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 CA-C-N 117.949 0.34 . . . . 0.0 110.701 177.007 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 1.3 tppm? -61.4 -39.87 92.3 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 123.529 0.732 . . . . 0.0 111.015 178.23 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 20.1 m -60.66 -42.07 96.27 Favored 'General case' 0 CA--C 1.533 0.302 0 O-C-N 121.732 -0.605 . . . . 0.0 111.187 175.301 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 43.2 mt -72.1 -40.37 66.67 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 C-N-CA 124.103 0.961 . . . . 0.0 111.44 -177.052 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 12.2 ptt180 -133.38 91.88 2.92 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 124.424 1.09 . . . . 0.0 108.244 174.477 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 17.5 p-10 -65.48 72.39 0.05 Allowed 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 125.946 1.699 . . . . 0.0 112.589 178.261 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 31.3 t70 . . . . . 0 C--O 1.251 1.163 0 C-N-CA 125.869 1.667 . . . . 0.0 108.072 176.431 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 0.619 0 CA-C-O 120.239 0.066 . . . . 0.0 110.887 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 30.0 m -85.63 -158.27 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.409 0 C-N-CA 124.078 0.951 . . . . 0.0 108.861 174.419 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -75.54 72.24 2.51 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 123.662 0.785 . . . . 0.0 110.574 178.427 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 25.1 mt-30 -95.81 -65.82 0.95 Allowed 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 124.627 1.171 . . . . 0.0 109.081 -179.066 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 55.0 m -100.31 -123.27 0.16 Allowed 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.835 1.254 . . . . 0.0 108.564 178.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -75.16 65.06 1.49 Allowed 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.853 1.261 . . . . 0.0 112.138 176.67 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 33.6 p-10 -18.99 -62.96 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 129.558 3.143 . . . . 0.0 117.22 -175.616 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 76.9 mtm -64.59 -48.08 76.27 Favored 'General case' 0 CA--C 1.529 0.152 0 C-N-CA 123.642 0.777 . . . . 0.0 110.791 -174.876 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 4.3 mp0 -64.88 -36.84 85.66 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 124.282 1.033 . . . . 0.0 110.022 176.498 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 44.3 tt0 -61.02 -64.98 0.77 Allowed 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 124.283 1.033 . . . . 0.0 110.503 -178.721 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 18.5 pt20 -59.41 -30.64 68.61 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 123.916 0.887 . . . . 0.0 111.789 -179.561 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 49.5 ttt-85 -66.1 -59.33 3.88 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.832 0.853 . . . . 0.0 110.999 177.278 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 22.8 mtp-105 -56.52 -38.15 71.42 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 124.748 1.219 . . . . 0.0 111.124 177.382 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 23.5 t80 -60.9 -53.46 56.98 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 125.61 1.564 . . . . 0.0 110.824 178.021 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 45.0 t80 -57.11 -49.12 76.88 Favored 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 123.806 0.842 . . . . 0.0 110.11 177.203 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 5.9 tm-20 -53.45 -57.21 11.46 Favored 'General case' 0 C--N 1.341 0.199 0 C-N-CA 123.549 0.74 . . . . 0.0 109.978 178.47 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -53.49 -55.66 23.5 Favored 'General case' 0 N--CA 1.456 -0.174 0 C-N-CA 124.052 0.941 . . . . 0.0 111.232 -178.084 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 63.3 tp -59.1 -54.65 44.6 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 124.462 1.105 . . . . 0.0 111.754 -176.467 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 21.3 m-70 -70.95 -37.78 72.84 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 122.956 0.502 . . . . 0.0 112.11 -173.532 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -67.86 120.63 75.17 Favored Pre-proline 0 CA--C 1.535 0.386 0 CA-C-O 118.957 -0.544 . . . . 0.0 110.737 -176.237 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 75.4 Cg_endo -80.62 -29.74 2.17 Favored 'Trans proline' 0 N--CA 1.455 -0.775 0 C-N-CA 123.39 2.727 . . . . 0.0 111.872 179.313 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 14.6 m120 -58.66 -34.79 71.61 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 125.062 1.345 . . . . 0.0 113.001 -170.803 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 85.6 mt -55.21 135.06 49.92 Favored 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 173.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 30.2 p-10 -83.59 48.08 1.37 Allowed 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 123.768 0.827 . . . . 0.0 112.683 -169.894 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 5.6 tm-20 70.81 -64.02 0.39 Allowed 'General case' 0 C--N 1.342 0.28 0 C-N-CA 126.071 1.748 . . . . 0.0 112.201 177.456 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 24.9 pt-20 -54.61 -44.88 73.49 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.89 0.876 . . . . 0.0 112.182 -174.893 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 45.1 mt-30 -64.24 -52.2 59.92 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 123.295 0.638 . . . . 0.0 110.671 178.296 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 26.5 ttp-105 -52.29 -47.85 65.66 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 124.765 1.226 . . . . 0.0 111.354 178.726 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 4.8 m-80 -70.98 -40.29 71.98 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 123.607 0.763 . . . . 0.0 111.379 -178.847 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.89 -45.49 92.33 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.251 0.62 . . . . 0.0 111.065 177.413 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 8.3 mmmm -56.1 -58.5 7.65 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 123.684 0.794 . . . . 0.0 109.44 174.013 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 50.8 mt -55.02 -53.43 34.14 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.275 0 C-N-CA 124.392 1.077 . . . . 0.0 112.209 -175.246 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.65 -43.03 97.96 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 118.557 0.617 . . . . 0.0 111.147 -176.553 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 30.4 t -58.41 -50.95 71.86 Favored 'General case' 0 C--N 1.342 0.263 0 C-N-CA 123.448 0.699 . . . . 0.0 110.211 178.071 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 48.5 mt -55.1 -48.49 76.02 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.189 0 C-N-CA 125.228 1.411 . . . . 0.0 110.894 177.86 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -60.09 -50.78 72.34 Favored 'General case' 0 N--CA 1.455 -0.181 0 CA-C-O 119.187 -0.435 . . . . 0.0 111.208 179.902 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -70.86 -24.54 62.53 Favored 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 113.297 0.851 . . . . 0.0 113.297 -177.979 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 32.7 t70 . . . . . 0 C--O 1.252 1.191 0 CA-C-O 117.052 -1.451 . . . . 0.0 109.946 -178.207 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.742 0 CA-C-O 120.687 0.279 . . . . 0.0 111.168 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 58.2 t -76.73 88.62 0.87 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 N-CA-C 108.364 -0.976 . . . . 0.0 108.364 179.757 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -74.74 -61.23 1.95 Allowed 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 123.997 0.919 . . . . 0.0 109.965 -179.724 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 1.7 pp0? -83.48 169.48 15.45 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 123.386 0.674 . . . . 0.0 110.825 177.042 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 87.4 p -136.93 43.17 2.4 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 124.508 1.123 . . . . 0.0 108.891 171.776 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 6.7 t80 -96.19 -46.77 6.32 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 125.082 1.353 . . . . 0.0 108.445 -179.784 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 39.9 t-20 -73.07 76.19 1.23 Allowed 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 124.563 1.145 . . . . 0.0 108.055 169.766 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 26.6 ttt -177.76 -55.08 0.01 OUTLIER 'General case' 0 N--CA 1.455 -0.208 0 C-N-CA 127.664 2.386 . . . . 0.0 105.031 -170.019 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 42.8 mt-30 -67.78 -52.13 40.77 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 105.895 -1.891 . . . . 0.0 105.895 169.198 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 95.4 mt-30 -82.04 82.93 7.45 Favored 'General case' 0 N--CA 1.448 -0.525 0 C-N-CA 125.301 1.44 . . . . 0.0 107.938 169.834 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 21.5 tp60 -116.44 -51.88 2.59 Favored 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 124.684 1.193 . . . . 0.0 108.514 174.129 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 13.8 tpt180 -65.31 -55.01 20.7 Favored 'General case' 0 C--N 1.34 0.189 0 C-N-CA 123.25 0.62 . . . . 0.0 109.84 174.032 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 81.5 mtp180 -52.66 -47.23 67.26 Favored 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 124.295 1.038 . . . . 0.0 110.521 178.382 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 8.7 t80 -61.48 -52.45 64.47 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 125.838 1.655 . . . . 0.0 112.095 179.362 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 91.1 t80 -58.26 -43.98 88.17 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 124.341 1.056 . . . . 0.0 110.631 178.54 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -63.78 -43.76 95.38 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.092 0.957 . . . . 0.0 110.849 177.92 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.49 -42.37 98.7 Favored 'General case' 0 C--N 1.341 0.225 0 C-N-CA 123.873 0.869 . . . . 0.0 111.188 176.766 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 58.4 tp -59.46 -51.59 69.23 Favored 'General case' 0 N--CA 1.454 -0.239 0 C-N-CA 123.414 0.685 . . . . 0.0 109.557 176.768 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 22.0 m-70 -93.84 49.52 1.35 Allowed 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 123.881 0.872 . . . . 0.0 110.774 -178.321 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -71.59 165.36 49.81 Favored Pre-proline 0 CA--C 1.539 0.543 0 CA-C-O 118.977 -0.535 . . . . 0.0 110.309 177.35 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -55.49 -65.82 0.1 Allowed 'Trans proline' 0 N--CA 1.457 -0.636 0 C-N-CA 123.148 2.565 . . . . 0.0 112.742 179.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 17.3 t-20 -167.73 70.32 0.09 Allowed 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 123.583 0.753 . . . . 0.0 109.762 -179.744 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -79.91 163.8 24.04 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 172.469 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 50.7 p-10 -79.87 17.87 0.89 Allowed 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 114.328 1.233 . . . . 0.0 114.328 -169.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 13.5 tp10 71.58 -44.92 0.6 Allowed 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 126.17 1.788 . . . . 0.0 113.187 -176.423 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 14.7 tp10 -57.22 -51.46 69.25 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 119.09 0.859 . . . . 0.0 110.638 178.072 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 45.7 mt-30 -62.15 -46.28 89.66 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 124.041 0.936 . . . . 0.0 111.151 178.883 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 45.9 ttm180 -55.42 -51.29 67.35 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 124.607 1.163 . . . . 0.0 110.402 178.455 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 47.6 t30 -61.5 -51.14 69.88 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 124.52 1.128 . . . . 0.0 110.396 179.54 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -54.51 -45.89 73.39 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 124.091 0.957 . . . . 0.0 111.743 -179.647 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 54.6 mmtt -55.62 -53.33 57.82 Favored 'General case' 0 C--N 1.34 0.169 0 C-N-CA 123.095 0.558 . . . . 0.0 110.214 173.06 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 89.9 mt -60.64 -35.21 62.19 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 C-N-CA 123.155 0.582 . . . . 0.0 111.866 -176.263 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 64.1 mttm -63.04 -48.41 78.81 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 119.162 0.892 . . . . 0.0 110.07 170.556 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 15.0 m -74.59 3.28 8.01 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 124.432 1.093 . . . . 0.0 113.459 -178.606 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 57.5 mt -107.85 -61.5 2.48 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.237 0 N-CA-C 106.867 -1.531 . . . . 0.0 106.867 171.543 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 19.7 tpp180 -81.4 68.96 7.93 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 125.187 1.395 . . . . 0.0 108.843 174.948 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -82.18 62.6 5.98 Favored 'General case' 0 CA--C 1.531 0.236 0 N-CA-C 108.501 -0.925 . . . . 0.0 108.501 174.814 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 11.6 t70 . . . . . 0 C--O 1.251 1.137 0 CA-C-O 117.184 -1.388 . . . . 0.0 110.37 -169.904 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.778 0 N-CA-C 111.74 0.274 . . . . 0.0 111.74 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 8.3 p -62.83 128.08 24.1 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.343 0 C-N-CA 123.77 0.828 . . . . 0.0 110.871 -177.718 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -81.7 67.44 7.68 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 124.438 1.095 . . . . 0.0 111.336 -174.412 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 87.7 mt-30 -71.86 -61.8 1.65 Allowed 'General case' 0 N--CA 1.456 -0.158 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 173.003 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 38.0 t -162.03 55.92 0.24 Allowed 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 124.152 0.981 . . . . 0.0 109.009 176.527 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 36.4 t80 -158.42 -58.15 0.07 Allowed 'General case' 0 C--N 1.34 0.152 0 C-N-CA 123.084 0.554 . . . . 0.0 110.957 178.308 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 21.0 m120 -78.68 63.61 3.49 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 123.97 0.908 . . . . 0.0 110.852 -173.84 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 26.7 ttt -169.83 -56.69 0.02 OUTLIER 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 126.959 2.104 . . . . 0.0 106.5 -175.144 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 22.0 mm100 -65.62 -38.95 90.87 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 123.93 0.892 . . . . 0.0 109.421 171.016 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 36.0 tt0 -49.58 -63.11 1.21 Allowed 'General case' 0 C--N 1.341 0.22 0 C-N-CA 124.848 1.259 . . . . 0.0 109.344 169.769 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 67.6 mt-30 -46.29 -33.8 4.02 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 125.861 1.664 . . . . 0.0 113.124 -169.957 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 44.8 mtt180 -56.34 -72.86 0.07 Allowed 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.446 1.098 . . . . 0.0 111.416 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -64.39 -38.38 90.82 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 124.284 1.033 . . . . 0.0 110.923 -178.743 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 49.2 t80 -59.43 -53.31 59.61 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 126.23 1.812 . . . . 0.0 110.966 -177.594 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 47.7 t80 -62.49 -45.04 94.82 Favored 'General case' 0 C--N 1.341 0.227 0 C-N-CA 123.562 0.745 . . . . 0.0 110.284 175.794 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 15.8 tp10 -55.74 -49.39 73.21 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 122.549 0.339 . . . . 0.0 110.866 -179.097 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.24 -51.46 68.85 Favored 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 123.8 0.84 . . . . 0.0 111.165 179.083 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 57.7 tp -60.65 -57.75 11.38 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 123.915 0.886 . . . . 0.0 111.2 -176.905 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 29.0 m-70 -83.41 61.81 6.39 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 124.738 1.215 . . . . 0.0 109.765 -178.659 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -158.6 120.27 1.93 Allowed Pre-proline 0 CA--C 1.533 0.326 0 C-N-CA 123.911 0.884 . . . . 0.0 109.061 177.69 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -77.9 -27.65 5.68 Favored 'Trans proline' 0 N--CA 1.455 -0.736 0 C-N-CA 123.316 2.677 . . . . 0.0 112.01 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -54.71 -53.68 51.8 Favored 'General case' 0 C--N 1.344 0.341 0 C-N-CA 123.711 0.804 . . . . 0.0 110.218 -179.335 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 81.1 mt -71.03 121.53 18.38 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 107.146 -1.428 . . . . 0.0 107.146 169.625 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 25.3 p30 -72.57 175.54 6.24 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-O 120.749 0.309 . . . . 0.0 110.742 -177.747 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -59.2 -51.39 70.18 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 123.186 0.594 . . . . 0.0 111.972 -171.729 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -62.77 -38.53 90.99 Favored 'General case' 0 CA--C 1.534 0.34 0 N-CA-C 111.867 0.321 . . . . 0.0 111.867 -179.551 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 85.5 mt-30 -62.28 -56.46 18.29 Favored 'General case' 0 C--N 1.34 0.163 0 C-N-CA 123.496 0.718 . . . . 0.0 110.823 178.523 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 31.6 ptt180 -66.29 -32.11 73.33 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 112.098 0.407 . . . . 0.0 112.098 -177.578 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 72.6 m-20 -64.93 -40.01 94.38 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 118.226 0.466 . . . . 0.0 110.864 172.224 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -63.38 -44.4 94.83 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 118.057 0.39 . . . . 0.0 110.669 175.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 11.9 mmmm -55.41 -51.49 66.69 Favored 'General case' 0 C--N 1.341 0.223 0 C-N-CA 123.237 0.615 . . . . 0.0 110.439 174.642 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 33.9 mt -51.74 -53.28 17.7 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.189 0 C-N-CA 123.404 0.682 . . . . 0.0 110.327 175.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 82.2 tttt -65.01 -25.84 68.03 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.039 0.535 . . . . 0.0 112.316 -177.359 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 49.5 m -74.34 -46.96 37.37 Favored 'General case' 0 CA--C 1.529 0.16 0 CA-C-N 118.691 0.678 . . . . 0.0 110.716 175.727 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 40.8 mt -63.72 -62.13 1.35 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.261 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 179.197 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 52.1 ttp85 -78.88 75.89 5.38 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 125.335 1.454 . . . . 0.0 107.72 170.09 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -61.68 76.3 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 127.336 2.254 . . . . 0.0 112.529 -178.129 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 19.2 t70 . . . . . 0 C--O 1.25 1.131 0 C-N-CA 125.5 1.52 . . . . 0.0 108.631 178.263 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.755 0 N-CA-C 111.643 0.238 . . . . 0.0 111.643 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 22.1 t -82.28 67.22 0.49 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 N-CA-C 108.25 -1.018 . . . . 0.0 108.25 179.664 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -84.6 86.61 7.29 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 124.357 1.063 . . . . 0.0 109.872 -175.86 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 36.6 mm-40 -77.07 71.69 3.58 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 123.711 0.804 . . . . 0.0 109.952 -179.892 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 40.8 p -158.49 53.19 0.43 Allowed 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 125.025 1.33 . . . . 0.0 108.113 -178.343 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 49.4 m-85 -80.22 76.24 7.0 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 124.085 0.954 . . . . 0.0 110.13 -173.438 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 24.8 t-20 -40.68 -54.04 2.67 Favored 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 126.332 1.853 . . . . 0.0 112.781 -178.723 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 97.4 mtp -60.47 -47.76 84.7 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 123.556 0.742 . . . . 0.0 111.566 -177.061 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 20.4 tt0 -57.9 -62.72 1.61 Allowed 'General case' 0 C--N 1.34 0.167 0 C-N-CA 123.8 0.84 . . . . 0.0 109.74 177.723 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.4 mp0 -48.42 -51.07 28.48 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 125.323 1.449 . . . . 0.0 111.314 -179.967 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 22.6 tt0 -54.33 -43.25 71.05 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 125.188 1.395 . . . . 0.0 111.635 176.473 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.48 -58.45 7.97 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 124.157 0.983 . . . . 0.0 109.488 177.226 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -61.39 -38.45 87.07 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-O 118.932 -0.556 . . . . 0.0 111.917 -178.933 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 25.1 m-85 -61.49 -43.79 98.24 Favored 'General case' 0 C--N 1.342 0.241 0 CA-C-N 118.999 0.818 . . . . 0.0 110.917 177.733 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 53.5 t80 -60.16 -46.74 88.64 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 118.082 0.401 . . . . 0.0 110.094 175.112 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 15.5 tp10 -56.38 -45.15 80.67 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 117.95 0.341 . . . . 0.0 110.876 177.934 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.15 -53.73 48.79 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 124.341 1.056 . . . . 0.0 111.336 -178.677 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 58.7 mt -61.95 -54.27 44.14 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 123.5 0.72 . . . . 0.0 110.575 -178.686 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 29.0 m-70 -85.1 66.21 9.63 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.265 1.026 . . . . 0.0 109.276 -177.82 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -127.46 140.34 37.72 Favored Pre-proline 0 CA--C 1.536 0.409 0 C-N-CA 125.743 1.617 . . . . 0.0 108.531 -178.544 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -76.89 -38.73 0.78 Allowed 'Trans proline' 0 N--CA 1.457 -0.636 0 C-N-CA 123.085 2.523 . . . . 0.0 112.841 -178.872 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 35.3 m120 -81.16 74.04 8.18 Favored 'General case' 0 C--N 1.34 0.185 0 C-N-CA 124.262 1.025 . . . . 0.0 110.498 -173.547 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 33.2 mt -98.86 140.14 33.48 Favored 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 112.937 0.717 . . . . 0.0 112.937 -174.762 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 52.1 p-10 -153.79 12.53 0.45 Allowed 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 126.561 1.944 . . . . 0.0 110.197 169.683 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 18.7 tp10 67.02 -47.5 0.47 Allowed 'General case' 0 C--N 1.346 0.449 0 C-N-CA 128.105 2.562 . . . . 0.0 113.177 -171.176 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 5.2 tm-20 -49.05 -45.21 42.52 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 124.789 1.235 . . . . 0.0 111.882 177.637 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 49.4 mm-40 -65.09 -41.54 94.88 Favored 'General case' 0 C--N 1.34 0.192 0 N-CA-C 109.902 -0.407 . . . . 0.0 109.902 -179.438 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 4.4 mmp_? -59.68 -61.85 2.31 Favored 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 177.492 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 17.4 t-20 -45.96 -50.18 15.04 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 126.128 1.771 . . . . 0.0 111.947 -177.878 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -55.7 -44.99 77.91 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 124.182 0.993 . . . . 0.0 111.595 176.259 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 26.1 mtpp -69.4 -42.08 75.56 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-O 118.432 -0.794 . . . . 0.0 111.777 179.635 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 10.3 mm -54.67 -53.97 27.13 Favored 'Isoleucine or valine' 0 C--N 1.345 0.377 0 CA-C-N 119.452 1.024 . . . . 0.0 110.144 -176.385 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 9.8 ptpp? -59.06 -41.41 87.85 Favored 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 111.889 0.329 . . . . 0.0 111.889 -178.579 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 37.6 m -60.49 -44.33 96.06 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 123.011 0.524 . . . . 0.0 111.117 177.559 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 63.1 mt -63.89 -42.55 96.18 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 C-N-CA 123.892 0.877 . . . . 0.0 110.24 179.109 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 34.3 mmt180 -58.89 -39.58 81.87 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 122.98 0.512 . . . . 0.0 110.65 175.608 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 65.9 m-20 -67.02 -53.66 29.17 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 122.738 0.415 . . . . 0.0 111.286 178.548 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 . . . . . 0 C--O 1.251 1.177 0 CA-C-O 117.517 -1.23 . . . . 0.0 110.487 -173.41 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.736 0 N-CA-C 111.734 0.272 . . . . 0.0 111.734 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 7.6 p -76.13 82.47 0.67 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.339 0 C-N-CA 123.692 0.797 . . . . 0.0 109.842 179.019 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -55.74 -41.34 73.77 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 124.155 0.982 . . . . 0.0 111.297 178.094 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 40.0 mt-30 -78.1 72.92 4.66 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 123.833 0.853 . . . . 0.0 110.17 177.945 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 86.1 p -147.0 -118.18 0.07 Allowed 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 124.044 0.937 . . . . 0.0 109.07 173.761 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 56.7 t80 -80.53 64.24 5.25 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 124.329 1.052 . . . . 0.0 109.664 -178.521 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 30.8 m120 -153.05 -65.26 0.15 Allowed 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 126.359 1.864 . . . . 0.0 106.874 -176.084 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 26.3 ptt? -58.95 -37.14 76.07 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 123.349 0.66 . . . . 0.0 110.321 172.428 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 40.3 mt-30 -54.36 -51.61 64.23 Favored 'General case' 0 C--N 1.341 0.235 0 C-N-CA 123.885 0.874 . . . . 0.0 110.064 171.401 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.3 tp-100 -58.64 -45.04 90.14 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 123.543 0.737 . . . . 0.0 110.905 -179.349 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 29.1 mm100 -60.86 -36.09 78.28 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-O 118.995 -0.526 . . . . 0.0 111.463 175.519 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.81 -39.46 83.98 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 118.473 0.579 . . . . 0.0 111.251 176.115 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 74.5 mtt85 -61.18 -46.71 89.38 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 118.42 0.554 . . . . 0.0 110.308 175.449 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 21.7 m-85 -61.14 -46.76 89.22 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 122.659 0.384 . . . . 0.0 111.261 175.855 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 52.8 t80 -54.81 -49.92 69.81 Favored 'General case' 0 C--O 1.225 -0.208 0 C-N-CA 124.034 0.933 . . . . 0.0 110.32 179.741 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -57.59 -52.81 63.9 Favored 'General case' 0 CA--C 1.531 0.229 0 N-CA-C 109.712 -0.477 . . . . 0.0 109.712 174.704 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -70.27 9.67 0.56 Allowed 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.885 1.274 . . . . 0.0 114.12 -179.987 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 64.6 tp -123.25 -37.48 2.69 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.457 1.103 . . . . 0.0 110.971 172.672 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 17.2 m-70 -90.95 -28.68 17.9 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.871 1.268 . . . . 0.0 113.464 -174.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -51.07 136.67 28.22 Favored Pre-proline 0 CA--C 1.543 0.687 0 C-N-CA 124.264 1.026 . . . . 0.0 112.297 -174.661 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_exo -45.53 -46.52 14.52 Favored 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 124.541 3.494 . . . . 0.0 115.777 -179.807 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 3.6 t30 -67.38 120.53 14.02 Favored 'General case' 0 C--N 1.34 0.172 0 N-CA-C 109.678 -0.49 . . . . 0.0 109.678 -177.699 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -156.04 130.28 8.76 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 122.86 0.464 . . . . 0.0 111.083 -173.911 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 1.8 p-10 -157.58 33.67 0.27 Allowed 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.11 0.964 . . . . 0.0 111.142 170.043 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.8 tm-20 72.33 -57.39 0.62 Allowed 'General case' 0 C--N 1.346 0.427 0 C-N-CA 127.054 2.142 . . . . 0.0 113.499 174.668 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 6.6 tm-20 -54.64 -49.53 70.34 Favored 'General case' 0 CA--C 1.529 0.158 0 C-N-CA 124.649 1.18 . . . . 0.0 110.416 -177.081 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 13.4 mm100 -56.27 -49.88 72.94 Favored 'General case' 0 C--N 1.341 0.233 0 C-N-CA 123.259 0.623 . . . . 0.0 109.764 -178.231 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 5.3 mpt_? -51.44 -73.82 0.04 OUTLIER 'General case' 0 CA--C 1.515 -0.385 0 C-N-CA 125.12 1.368 . . . . 0.0 110.745 178.023 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 18.3 m-80 -54.24 -38.15 65.42 Favored 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 111.914 0.339 . . . . 0.0 111.914 -170.787 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -61.16 -58.14 9.58 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 123.071 0.549 . . . . 0.0 111.812 175.933 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 14.8 ptpt -67.83 -44.23 77.72 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 118.008 0.367 . . . . 0.0 111.132 -174.679 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 6.3 mm -48.05 -52.04 8.01 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.16 0 C-N-CA 125.686 1.595 . . . . 0.0 109.962 174.148 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 23.0 ttmm -60.91 -48.95 79.44 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 123.804 0.842 . . . . 0.0 111.248 -178.763 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 83.7 p -62.79 -40.88 98.69 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 122.553 0.341 . . . . 0.0 111.849 -178.176 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 61.3 mt -63.3 -44.13 98.98 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.321 0 C-N-CA 124.075 0.95 . . . . 0.0 109.057 175.021 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 33.2 ttm180 -80.88 55.01 2.31 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 125.176 1.391 . . . . 0.0 110.478 179.447 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -109.23 -51.35 2.89 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 125.58 1.552 . . . . 0.0 108.666 175.341 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 29.8 t70 . . . . . 0 C--O 1.25 1.106 0 CA-C-O 117.365 -1.303 . . . . 0.0 108.063 176.952 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 0.65 0 CA-C-O 119.17 -0.443 . . . . 0.0 110.851 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 14.6 m 40.83 -116.7 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 C-N-CA 126.105 1.762 . . . . 0.0 112.572 177.608 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -57.78 -33.13 68.2 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 125.03 1.332 . . . . 0.0 113.539 -179.385 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 6.6 tm0? 70.38 -69.06 0.18 Allowed 'General case' 0 C--N 1.342 0.255 0 C-N-CA 126.531 1.932 . . . . 0.0 110.875 -175.891 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 7.8 m -66.41 -7.04 16.72 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 124.882 1.273 . . . . 0.0 114.211 -169.997 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 36.3 p90 -146.19 30.96 1.02 Allowed 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 124.2 1.0 . . . . 0.0 110.845 169.937 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -132.92 -68.48 0.59 Allowed 'General case' 0 C--N 1.338 0.102 0 C-N-CA 125.16 1.384 . . . . 0.0 108.926 175.059 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 96.1 mmm -68.37 -33.98 75.25 Favored 'General case' 0 N--CA 1.456 -0.142 0 C-N-CA 123.623 0.769 . . . . 0.0 110.099 176.339 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 21.3 tt0 -54.49 -62.46 1.64 Allowed 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 169.92 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 72.7 mt-30 -60.64 -35.06 75.25 Favored 'General case' 0 C--N 1.34 0.153 0 C-N-CA 124.101 0.96 . . . . 0.0 111.97 -175.1 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -52.72 -48.97 66.3 Favored 'General case' 0 N--CA 1.456 -0.17 0 C-N-CA 123.058 0.543 . . . . 0.0 109.666 171.582 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 16.2 mmm-85 -67.91 -34.28 76.32 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-O 118.47 -0.776 . . . . 0.0 112.88 175.907 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 28.4 mmt85 -56.58 -51.7 67.64 Favored 'General case' 0 C--N 1.341 0.236 0 CA-C-N 119.175 0.898 . . . . 0.0 109.705 175.166 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 11.0 m-85 -56.47 -52.19 65.62 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 123.814 0.845 . . . . 0.0 110.918 173.419 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 31.6 t80 -78.97 60.91 3.03 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.485 1.114 . . . . 0.0 109.883 -179.529 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 178.94 -55.03 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 127.339 2.256 . . . . 0.0 107.362 -174.724 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.37 -44.99 96.23 Favored 'General case' 0 C--N 1.34 0.181 0 C-N-CA 124.899 1.279 . . . . 0.0 110.565 175.232 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 89.4 mt -58.33 -47.43 83.76 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 123.118 0.567 . . . . 0.0 109.844 172.343 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 22.5 m-70 -86.37 54.96 3.34 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 124.412 1.085 . . . . 0.0 110.331 -176.535 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 10.6 t0 -124.99 85.18 58.14 Favored Pre-proline 0 CA--C 1.535 0.373 0 C-N-CA 124.425 1.09 . . . . 0.0 109.382 -175.93 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -82.14 59.4 7.02 Favored 'Trans proline' 0 N--CA 1.456 -0.71 0 C-N-CA 123.856 3.037 . . . . 0.0 109.887 179.626 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -155.72 -58.62 0.1 Allowed 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 124.586 1.154 . . . . 0.0 108.981 179.286 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 91.2 mt -70.78 144.16 50.96 Favored 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 174.699 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 29.8 p-10 -79.51 174.66 11.35 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-O 121.195 0.521 . . . . 0.0 110.867 179.943 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 35.8 tp10 -60.88 -36.75 80.02 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 123.772 0.829 . . . . 0.0 111.592 -176.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 51.9 mt-10 -59.76 -57.51 12.59 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 123.322 0.649 . . . . 0.0 110.735 179.728 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 37.3 mt-30 -59.59 -47.76 84.31 Favored 'General case' 0 CA--C 1.529 0.148 0 C-N-CA 124.042 0.937 . . . . 0.0 110.787 -178.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 12.1 ttp-105 -52.83 -55.13 25.28 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 124.716 1.206 . . . . 0.0 111.046 176.972 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 6.5 m120 -59.95 -44.91 94.11 Favored 'General case' 0 CA--C 1.529 0.156 0 C-N-CA 122.693 0.397 . . . . 0.0 110.858 179.324 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.19 -51.08 69.34 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 123.991 0.916 . . . . 0.0 111.744 -177.768 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 19.7 ptpt -65.09 -41.41 95.02 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 118.113 0.415 . . . . 0.0 111.302 179.499 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 5.7 mt -60.39 -52.27 63.33 Favored 'Isoleucine or valine' 0 C--N 1.34 0.171 0 CA-C-O 118.755 -0.64 . . . . 0.0 111.176 -179.452 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 15.0 ptmm? -62.09 -37.67 85.95 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 118.856 0.753 . . . . 0.0 111.591 -178.783 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 55.7 m -61.24 -50.51 72.76 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 122.9 0.48 . . . . 0.0 111.014 177.531 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 89.3 mt -60.88 -51.71 70.02 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 C-N-CA 123.89 0.876 . . . . 0.0 110.195 179.194 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 37.7 ttm180 -60.24 -36.29 77.42 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 124.846 1.258 . . . . 0.0 111.624 -177.172 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -74.45 80.68 1.92 Allowed 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 123.729 0.812 . . . . 0.0 109.293 173.391 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 . . . . . 0 C--O 1.251 1.144 0 C-N-CA 126.591 1.957 . . . . 0.0 110.658 178.27 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.74 0 N-CA-C 111.639 0.237 . . . . 0.0 111.639 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 87.3 t -70.11 109.16 2.54 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.205 0 N-CA-C 108.979 -0.749 . . . . 0.0 108.979 179.937 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -79.44 -88.02 0.06 Allowed 'General case' 0 CA--C 1.531 0.238 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 176.789 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 65.6 mm-40 47.19 57.61 5.6 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 125.497 1.519 . . . . 0.0 111.606 177.906 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 18.2 t -91.16 -147.95 0.21 Allowed 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.711 1.204 . . . . 0.0 109.195 -177.486 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 4.1 t80 -68.84 96.54 0.76 Allowed 'General case' 0 N--CA 1.446 -0.652 0 N-CA-C 106.843 -1.54 . . . . 0.0 106.843 170.715 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 51.2 t30 -38.39 -54.4 1.46 Allowed 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 125.999 1.719 . . . . 0.0 112.66 -179.716 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 13.5 tpt -81.9 64.49 6.62 Favored 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 123.421 0.688 . . . . 0.0 109.963 178.577 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 3.4 tm0? 176.42 -48.21 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 128.273 2.629 . . . . 0.0 106.786 -177.586 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 63.6 tt0 -57.27 -49.51 75.85 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 125.242 1.417 . . . . 0.0 109.468 172.619 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -57.75 -38.06 74.73 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.868 1.267 . . . . 0.0 111.617 174.487 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 40.6 tpt85 -67.65 -51.81 45.55 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 123.715 0.806 . . . . 0.0 110.631 -178.768 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 78.2 ttt-85 -57.74 -51.71 68.44 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 125.586 1.554 . . . . 0.0 110.645 176.793 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 13.1 t80 -47.14 -59.74 2.94 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 126.243 1.817 . . . . 0.0 111.513 173.508 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 50.9 t80 -56.09 -49.18 74.56 Favored 'General case' 0 N--CA 1.456 -0.141 0 C-N-CA 124.128 0.971 . . . . 0.0 110.843 -179.42 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -56.77 -54.52 45.31 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 123.442 0.697 . . . . 0.0 110.748 -177.822 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.21 -44.52 97.15 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 123.658 0.783 . . . . 0.0 111.944 -178.349 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 59.8 tp -61.36 -53.2 59.75 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 124.23 1.012 . . . . 0.0 110.993 -179.621 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 19.4 m-70 -76.62 -50.98 12.46 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 123.593 0.757 . . . . 0.0 111.951 -173.694 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 9.5 t0 -67.23 124.29 88.6 Favored Pre-proline 0 CA--C 1.535 0.389 0 CA-C-O 118.87 -0.586 . . . . 0.0 109.668 -174.84 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_endo -76.15 -10.03 19.3 Favored 'Trans proline' 0 N--CA 1.456 -0.707 0 C-N-CA 123.412 2.741 . . . . 0.0 114.355 -171.937 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -62.56 -31.84 72.7 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 114.382 1.253 . . . . 0.0 114.382 -169.981 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 10.6 mp -63.67 146.63 53.44 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 118.555 0.616 . . . . 0.0 110.073 177.153 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 44.0 p-10 -84.62 29.35 0.61 Allowed 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 114.451 1.278 . . . . 0.0 114.451 -169.71 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 76.34 -58.37 0.53 Allowed 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 124.852 1.261 . . . . 0.0 111.384 -174.878 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 5.6 mp0 -56.88 -49.95 73.98 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 123.385 0.674 . . . . 0.0 110.663 -178.732 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 59.7 mt-30 -51.61 -60.0 3.65 Favored 'General case' 0 C--N 1.34 0.17 0 C-N-CA 124.44 1.096 . . . . 0.0 111.084 178.423 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 10.7 ptp85 -63.42 -44.97 93.08 Favored 'General case' 0 C--N 1.342 0.251 0 CA-C-O 119.253 -0.403 . . . . 0.0 110.75 -175.883 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -55.23 -51.86 65.23 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 123.748 0.819 . . . . 0.0 111.094 -178.132 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -53.78 -53.52 51.15 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 123.641 0.777 . . . . 0.0 111.485 -178.475 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 19.9 ptpt -69.8 -36.94 76.08 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-O 118.648 -0.691 . . . . 0.0 112.007 -178.704 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 44.4 mt -59.44 -45.3 93.73 Favored 'Isoleucine or valine' 0 C--N 1.34 0.189 0 CA-C-N 119.1 0.864 . . . . 0.0 110.162 178.855 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 44.2 mmtm -59.29 -43.27 92.57 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 122.49 0.316 . . . . 0.0 110.496 175.639 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 16.0 m -63.75 -42.21 97.89 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.281 0.632 . . . . 0.0 111.714 179.104 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 30.5 mt -61.56 -49.41 84.51 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.195 0 C-N-CA 125.128 1.371 . . . . 0.0 109.228 176.884 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -82.87 51.47 1.92 Allowed 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 124.714 1.206 . . . . 0.0 110.57 -179.679 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 3.9 p30 -81.99 -36.19 28.14 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 123.299 0.64 . . . . 0.0 109.792 171.431 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 10.0 p-10 . . . . . 0 C--O 1.252 1.191 0 C-N-CA 124.908 1.283 . . . . 0.0 110.459 176.632 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.75 0 CA-C-O 120.706 0.288 . . . . 0.0 111.189 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 24.7 t -80.37 76.03 0.85 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 -179.388 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -64.52 -41.57 96.3 Favored 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 123.926 0.89 . . . . 0.0 110.838 178.527 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 7.0 pt20 -139.05 178.25 7.3 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 124.91 1.284 . . . . 0.0 109.489 177.095 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 53.0 m -76.4 102.38 5.94 Favored 'General case' 0 N--CA 1.448 -0.555 0 N-CA-C 106.133 -1.802 . . . . 0.0 106.133 169.681 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 62.2 m-85 -79.24 66.61 4.74 Favored 'General case' 0 N--CA 1.457 -0.115 0 CA-C-O 121.721 0.772 . . . . 0.0 109.645 179.498 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 29.6 m-80 -136.14 -49.39 0.68 Allowed 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 126.505 1.922 . . . . 0.0 108.019 -177.936 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 25.4 ptt? -63.9 -40.62 96.93 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 122.826 0.45 . . . . 0.0 110.498 171.05 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 31.5 tt0 -61.22 -48.18 82.69 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 123.086 0.555 . . . . 0.0 110.05 175.205 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 21.4 tt0 -55.47 -51.69 66.11 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 123.826 0.85 . . . . 0.0 110.221 177.705 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 20.1 tt0 -53.81 -37.02 63.11 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 125.286 1.434 . . . . 0.0 111.508 176.47 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 13.4 mmp_? -70.78 -51.29 27.92 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 118.883 0.765 . . . . 0.0 111.64 178.832 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.42 -50.38 67.73 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 118.897 0.772 . . . . 0.0 109.996 176.973 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 78.1 t80 -50.32 -55.88 13.63 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 126.941 2.096 . . . . 0.0 112.081 174.172 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 49.4 t80 -58.82 -48.66 80.52 Favored 'General case' 0 C--N 1.339 0.14 0 C-N-CA 124.6 1.16 . . . . 0.0 110.927 -178.298 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -54.91 -54.67 39.64 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 123.494 0.717 . . . . 0.0 109.806 178.985 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -56.68 -49.08 76.16 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 122.616 0.366 . . . . 0.0 111.904 -179.671 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 54.4 tp -58.43 -53.67 55.68 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 124.084 0.954 . . . . 0.0 111.333 -178.837 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 19.4 m-70 -77.39 -45.77 24.86 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.783 0.833 . . . . 0.0 112.648 -171.489 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 80.0 m-20 -62.9 130.7 94.19 Favored Pre-proline 0 CA--C 1.537 0.456 0 CA-C-N 118.215 0.462 . . . . 0.0 110.647 -171.254 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -70.77 -29.28 19.3 Favored 'Trans proline' 0 N--CA 1.457 -0.634 0 C-N-CA 123.973 3.115 . . . . 0.0 113.562 -169.755 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 9.8 p-10 -58.76 -27.99 65.48 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 118.493 0.588 . . . . 0.0 111.796 -179.863 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -84.08 72.13 10.5 Favored 'General case' 0 C--N 1.342 0.273 0 N-CA-C 106.112 -1.81 . . . . 0.0 106.112 169.442 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 -77.29 58.09 1.58 Allowed 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 125.612 1.565 . . . . 0.0 112.687 -169.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 22.6 tt0 70.76 157.59 0.17 Allowed 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 125.239 1.416 . . . . 0.0 110.63 -176.919 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.3 tp10 73.8 -56.13 0.65 Allowed 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 127.027 2.131 . . . . 0.0 110.811 -175.392 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 50.9 mt-30 -54.86 -61.59 2.21 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 125.31 1.444 . . . . 0.0 110.01 175.632 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 19.4 ptt180 -63.23 -38.88 92.92 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 123.599 0.76 . . . . 0.0 111.76 178.861 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 14.4 m120 -61.0 -45.02 96.5 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 118.387 0.539 . . . . 0.0 111.099 179.924 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -60.12 -47.54 85.48 Favored 'General case' 0 CA--C 1.529 0.165 0 C-N-CA 123.564 0.745 . . . . 0.0 110.439 176.639 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 30.6 tttt -55.32 -51.17 67.59 Favored 'General case' 0 N--CA 1.448 -0.541 0 C-N-CA 123.441 0.697 . . . . 0.0 111.396 175.748 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 58.2 mt -58.39 -44.73 89.2 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.205 0 C-N-CA 124.269 1.028 . . . . 0.0 110.293 -179.361 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 27.2 ttpp -58.77 -46.95 86.32 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 123.488 0.715 . . . . 0.0 111.251 177.071 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 88.9 p -68.22 -37.87 81.3 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 118.438 0.563 . . . . 0.0 111.94 -179.705 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 68.8 mt -64.82 -60.7 2.34 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.188 0 C-N-CA 123.907 0.883 . . . . 0.0 110.149 179.238 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 17.7 ptp180 -133.66 70.38 1.46 Allowed 'General case' 0 N--CA 1.456 -0.133 0 C-N-CA 123.99 0.916 . . . . 0.0 109.734 -173.215 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -53.26 -48.83 67.94 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 124.363 1.065 . . . . 0.0 111.556 177.968 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 38.2 t70 . . . . . 0 C--O 1.25 1.092 0 CA-C-O 116.536 -1.697 . . . . 0.0 110.724 179.125 . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.733 0 N-CA-C 111.484 0.179 . . . . 0.0 111.484 . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 34.4 m -61.07 -22.65 27.64 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.23 0 C-N-CA 123.904 0.882 . . . . 0.0 112.967 -179.532 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -55.4 -46.44 76.59 Favored 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 124.655 1.182 . . . . 0.0 110.574 174.141 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 8.8 tp-100 -68.89 97.56 0.85 Allowed 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 175.022 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 42.5 m -102.03 57.41 0.81 Allowed 'General case' 0 N--CA 1.448 -0.557 0 C-N-CA 125.515 1.526 . . . . 0.0 107.595 -175.766 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 44.1 p90 -53.31 -25.39 14.69 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 124.777 1.231 . . . . 0.0 111.365 177.026 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 5.3 p-10 -53.63 -32.1 49.96 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 124.354 1.062 . . . . 0.0 112.29 178.286 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 95.0 mmm -63.65 -51.56 64.59 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 123.258 0.623 . . . . 0.0 110.936 -179.807 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -67.22 -38.46 85.28 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-O 119.236 -0.412 . . . . 0.0 110.649 176.105 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -82.93 51.1 1.85 Allowed 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.227 1.411 . . . . 0.0 109.969 176.272 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? -165.17 -52.78 0.03 OUTLIER 'General case' 0 CA--C 1.523 -0.075 0 C-N-CA 126.777 2.031 . . . . 0.0 106.465 -178.947 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 6.1 tmm_? -50.78 -48.56 59.35 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 125.435 1.494 . . . . 0.0 109.874 171.961 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 19.2 ptp180 -63.87 -45.24 90.34 Favored 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 112.582 0.586 . . . . 0.0 112.582 -179.01 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 60.8 m-85 -64.11 -47.42 80.07 Favored 'General case' 0 C--N 1.339 0.139 0 C-N-CA 122.66 0.384 . . . . 0.0 110.386 -179.66 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 64.1 t80 -56.64 -46.82 80.77 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 123.902 0.881 . . . . 0.0 110.495 175.236 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 12.9 tp10 -58.77 -58.47 8.46 Favored 'General case' 0 N--CA 1.455 -0.225 0 C-N-CA 122.949 0.5 . . . . 0.0 110.027 -179.228 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -52.93 -47.24 68.17 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 124.648 1.179 . . . . 0.0 111.588 -179.982 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 63.7 tp -60.14 -49.93 75.69 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.095 0.958 . . . . 0.0 110.612 178.221 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 17.1 m-70 -85.46 54.76 3.23 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.135 0.974 . . . . 0.0 110.453 -178.996 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 73.7 m-20 -135.29 83.49 38.16 Favored Pre-proline 0 CA--C 1.532 0.288 0 C-N-CA 124.698 1.199 . . . . 0.0 108.68 171.482 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_exo -51.99 -42.93 55.72 Favored 'Trans proline' 0 N--CA 1.459 -0.517 0 C-N-CA 124.118 3.212 . . . . 0.0 113.167 175.721 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 50.3 t30 -55.29 -46.66 76.2 Favored 'General case' 0 C--N 1.341 0.21 0 C-N-CA 124.6 1.16 . . . . 0.0 111.651 -178.611 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -73.04 108.81 6.14 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 106.734 -1.58 . . . . 0.0 106.734 173.346 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 1.9 p30 -64.79 170.14 4.47 Favored 'General case' 0 CA--C 1.531 0.218 0 N-CA-C 111.538 0.199 . . . . 0.0 111.538 -172.389 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -47.05 -41.73 17.27 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 124.659 1.184 . . . . 0.0 112.683 -177.093 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 14.3 tp10 -60.83 -58.47 8.31 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 118.354 0.525 . . . . 0.0 110.976 179.503 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 71.9 mt-30 -58.15 -50.55 73.11 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 124.211 1.004 . . . . 0.0 110.806 -178.507 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 17.9 ttp180 -56.83 -55.17 37.83 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 125.594 1.558 . . . . 0.0 110.999 -179.813 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 -60.04 -42.2 93.92 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 122.806 0.443 . . . . 0.0 111.109 179.474 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.96 -43.34 91.27 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 123.196 0.599 . . . . 0.0 111.167 177.509 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 25.8 mmtp -58.5 -58.46 8.42 Favored 'General case' 0 C--N 1.341 0.229 0 C-N-CA 122.875 0.47 . . . . 0.0 110.181 174.883 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 30.3 mm -48.87 -51.77 11.32 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 C-N-CA 123.623 0.769 . . . . 0.0 110.724 -179.522 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 66.0 tttp -61.41 -54.85 38.21 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 124.303 1.041 . . . . 0.0 111.221 -178.168 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 85.6 p -59.3 -38.67 80.81 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 123.261 0.625 . . . . 0.0 112.141 -175.593 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 71.6 mt -61.04 -55.07 27.19 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 C-N-CA 123.578 0.751 . . . . 0.0 110.442 -179.502 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 19.5 ptp180 -72.05 -49.51 36.08 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 118.155 0.434 . . . . 0.0 111.447 -178.225 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -92.87 67.75 4.43 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 124.697 1.199 . . . . 0.0 108.631 177.979 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 8.8 p-10 . . . . . 0 C--O 1.251 1.142 0 CA-C-O 116.857 -1.544 . . . . 0.0 110.394 178.033 . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 0.649 0 CA-C-O 120.082 -0.009 . . . . 0.0 110.993 . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 19.6 m -147.2 149.38 15.68 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.235 0 C-N-CA 125.084 1.354 . . . . 0.0 109.025 176.482 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -158.68 79.48 0.79 Allowed 'General case' 0 N--CA 1.456 -0.142 0 N-CA-C 107.982 -1.118 . . . . 0.0 107.982 176.261 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 5.6 pt20 -147.79 52.23 1.04 Allowed 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 124.326 1.05 . . . . 0.0 109.757 -174.102 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 67.1 m -82.71 -96.63 0.05 Allowed 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 124.102 0.961 . . . . 0.0 109.96 -179.008 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -84.94 69.04 10.74 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 124.386 1.074 . . . . 0.0 108.205 177.703 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 53.0 m-80 -49.0 -50.18 37.13 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 125.59 1.556 . . . . 0.0 113.282 -170.309 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 25.2 ptp -63.83 -29.61 70.79 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 112.861 0.689 . . . . 0.0 112.861 -177.317 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 42.5 tt0 -79.6 -44.01 21.83 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 123.388 0.675 . . . . 0.0 109.788 176.615 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 20.3 tt0 -56.6 -41.58 77.26 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.532 1.133 . . . . 0.0 110.775 176.795 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 18.4 tt0 -54.4 -29.76 50.03 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 126.204 1.801 . . . . 0.0 112.021 175.042 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 21.0 mmt85 -70.71 -57.54 4.57 Favored 'General case' 0 C--N 1.341 0.2 0 CA-C-N 118.972 0.806 . . . . 0.0 109.397 177.668 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 79.7 mtt85 -50.58 -47.67 57.86 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 124.215 1.006 . . . . 0.0 110.632 177.76 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 31.2 t80 -48.68 -51.35 28.97 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 126.423 1.889 . . . . 0.0 111.287 173.891 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 18.2 m-30 -68.0 -35.67 78.72 Favored 'General case' 0 C--O 1.225 -0.218 0 C-N-CA 123.233 0.613 . . . . 0.0 111.649 179.142 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -60.55 -25.23 66.0 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 119.803 1.183 . . . . 0.0 111.64 175.813 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -84.45 -49.79 8.34 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 123.234 0.614 . . . . 0.0 111.497 171.727 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 34.4 tp -82.42 -57.47 3.34 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.065 0.946 . . . . 0.0 111.413 -170.295 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 25.0 m170 -77.68 69.63 3.95 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 125.404 1.482 . . . . 0.0 108.778 177.727 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -158.45 158.38 29.56 Favored Pre-proline 0 CA--C 1.534 0.333 0 C-N-CA 124.666 1.186 . . . . 0.0 107.866 -172.157 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -67.5 42.2 0.21 Allowed 'Trans proline' 0 CA--C 1.544 1.01 0 C-N-CA 123.737 2.958 . . . . 0.0 114.219 169.767 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 14.9 t-20 61.16 92.89 0.05 OUTLIER 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 126.955 2.102 . . . . 0.0 112.578 177.777 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 78.2 mt -64.51 162.32 15.59 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 169.729 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 10.0 p30 -54.63 144.41 21.87 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 123.088 0.555 . . . . 0.0 110.646 178.182 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 15.3 mp0 -52.45 -42.18 63.94 Favored 'General case' 0 C--O 1.226 -0.143 0 C-N-CA 124.411 1.084 . . . . 0.0 112.013 -173.932 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.4 tm-20 -56.43 -61.73 2.21 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 122.915 0.486 . . . . 0.0 110.551 -177.757 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 26.9 mm100 -61.2 -51.95 66.86 Favored 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 123.135 0.574 . . . . 0.0 110.916 179.197 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 32.2 ttp-105 -57.19 -61.98 2.08 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 123.693 0.797 . . . . 0.0 110.706 -174.142 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 14.4 t-20 -59.39 -39.7 84.19 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 123.974 0.91 . . . . 0.0 111.174 -175.548 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -57.15 -51.27 70.0 Favored 'General case' 0 C--N 1.342 0.257 0 C-N-CA 122.695 0.398 . . . . 0.0 110.83 176.447 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 59.8 mtpt -59.3 -54.84 42.16 Favored 'General case' 0 C--N 1.341 0.238 0 C-N-CA 123.081 0.552 . . . . 0.0 110.59 177.381 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 14.6 mm -51.14 -49.73 28.0 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.276 0 C-N-CA 124.207 1.003 . . . . 0.0 110.682 -178.384 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 27.7 tptp -73.07 -42.21 63.3 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 123.216 0.606 . . . . 0.0 111.973 -175.445 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 99.1 p -61.97 -34.39 76.05 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 118.647 0.658 . . . . 0.0 111.015 178.873 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 90.7 mt -73.11 -49.47 38.28 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.255 0 C-N-CA 124.518 1.127 . . . . 0.0 109.596 175.682 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 81.5 mtp180 -89.77 61.78 5.52 Favored 'General case' 0 CA--C 1.529 0.165 0 C-N-CA 124.228 1.011 . . . . 0.0 108.822 176.542 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 30.2 t0 -77.75 83.32 4.11 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 123.817 0.847 . . . . 0.0 109.387 -176.318 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 33.3 t70 . . . . . 0 C--O 1.25 1.106 0 C-N-CA 125.398 1.479 . . . . 0.0 108.698 175.509 . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 0.72 0 N-CA-C 111.651 0.241 . . . . 0.0 111.651 . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 16.4 t 59.13 76.27 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.28 0 C-N-CA 125.251 1.42 . . . . 0.0 110.002 -179.561 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -64.72 130.14 42.43 Favored 'General case' 0 N--CA 1.456 -0.169 0 N-CA-C 109.496 -0.557 . . . . 0.0 109.496 176.868 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 29.3 mm100 -81.81 40.8 0.62 Allowed 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 124.093 0.957 . . . . 0.0 111.715 -175.333 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 21.5 m -59.55 -34.24 72.42 Favored 'General case' 0 N--CA 1.456 -0.171 0 C-N-CA 124.185 0.994 . . . . 0.0 111.531 177.806 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 48.3 p90 -74.6 28.68 0.08 Allowed 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.733 1.613 . . . . 0.0 113.386 -178.816 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 13.2 m-80 -144.43 -53.89 0.33 Allowed 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 125.178 1.391 . . . . 0.0 109.416 -177.783 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -102.03 -33.83 9.57 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 123.938 0.895 . . . . 0.0 113.222 -173.638 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 27.6 mm100 -76.12 -57.3 3.95 Favored 'General case' 0 C--N 1.343 0.296 0 CA-C-N 119.712 1.142 . . . . 0.0 107.946 169.858 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 20.2 mt-30 -82.47 106.34 14.25 Favored 'General case' 0 N--CA 1.449 -0.504 0 N-CA-C 107.394 -1.336 . . . . 0.0 107.394 178.476 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 17.8 tp60 -149.51 -51.21 0.15 Allowed 'General case' 0 CA--C 1.532 0.25 0 CA-C-O 118.923 -0.561 . . . . 0.0 111.834 -176.663 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -70.11 -79.59 0.06 Allowed 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 118.851 0.751 . . . . 0.0 110.557 -172.874 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -55.88 -26.2 46.01 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 124.522 1.129 . . . . 0.0 112.243 173.688 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 62.2 t80 -67.75 -49.43 62.57 Favored 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 125.202 1.401 . . . . 0.0 110.973 178.94 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 70.4 t80 -58.08 -41.15 82.82 Favored 'General case' 0 C--N 1.34 0.19 0 CA-C-O 119.194 -0.431 . . . . 0.0 110.128 174.31 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 15.3 tp10 -59.23 -57.97 10.67 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 118.356 0.525 . . . . 0.0 110.042 176.68 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -52.68 -46.46 67.27 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 124.672 1.189 . . . . 0.0 112.359 -178.245 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 73.0 mt -62.75 -62.14 1.93 Allowed 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.211 0.604 . . . . 0.0 109.775 175.776 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 19.6 m-70 -84.97 48.82 1.62 Allowed 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.53 1.132 . . . . 0.0 110.711 -177.095 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -77.73 162.13 69.16 Favored Pre-proline 0 CA--C 1.538 0.488 0 N-CA-C 108.394 -0.965 . . . . 0.0 108.394 173.711 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -79.13 65.2 8.88 Favored 'Trans proline' 0 N--CA 1.454 -0.842 0 C-N-CA 124.243 3.295 . . . . 0.0 109.861 179.704 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 31.0 m120 59.25 67.78 0.87 Allowed 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 126.792 2.037 . . . . 0.0 112.768 169.97 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 82.0 mt -67.92 166.42 15.71 Favored 'General case' 0 CA--C 1.532 0.283 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 169.72 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 48.7 p-10 -75.9 26.35 0.11 Allowed 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.851 1.26 . . . . 0.0 113.91 -174.54 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 73.01 -55.61 0.68 Allowed 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 126.03 1.732 . . . . 0.0 111.689 -174.954 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -53.83 -54.53 37.12 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 125.094 1.358 . . . . 0.0 111.303 -177.567 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 42.7 mt-30 -61.22 -45.31 95.09 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 123.686 0.794 . . . . 0.0 111.128 -178.813 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 37.6 ttm105 -56.98 -55.85 29.32 Favored 'General case' 0 C--N 1.34 0.196 0 C-N-CA 122.845 0.458 . . . . 0.0 110.118 177.394 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 47.9 m-20 -54.35 -45.19 72.68 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 123.994 0.918 . . . . 0.0 111.052 -179.865 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.43 -43.97 88.94 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 123.351 0.66 . . . . 0.0 111.302 177.165 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 61.2 mtpt -62.06 -45.15 94.79 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-O 119.079 -0.486 . . . . 0.0 110.91 176.986 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 45.2 mm -57.98 -47.34 86.85 Favored 'Isoleucine or valine' 0 C--N 1.342 0.259 0 CA-C-N 118.851 0.751 . . . . 0.0 110.328 176.183 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 63.0 mttp -58.75 -39.16 80.13 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 123.035 0.534 . . . . 0.0 111.563 177.52 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 40.4 m -63.72 -46.42 85.5 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 122.853 0.461 . . . . 0.0 110.946 177.189 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 74.1 mt -63.14 -42.16 95.52 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 C-N-CA 123.567 0.747 . . . . 0.0 110.2 178.892 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 1.5 mmp_? -59.33 -52.24 66.49 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 124.043 0.937 . . . . 0.0 110.035 176.611 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -82.97 70.54 9.99 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 124.361 1.064 . . . . 0.0 109.595 179.535 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 32.9 t70 . . . . . 0 C--O 1.252 1.197 0 CA-C-O 117.184 -1.388 . . . . 0.0 109.257 -179.671 . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 0.684 0 CA-C-O 120.771 0.32 . . . . 0.0 111.154 . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 41.0 t -79.02 82.21 1.02 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.238 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 -179.751 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -78.95 69.8 5.17 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 124.212 1.005 . . . . 0.0 109.929 179.187 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 10.2 tt0 -68.18 136.61 53.89 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 123.607 0.763 . . . . 0.0 109.897 179.79 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 30.7 p -76.82 -70.0 0.49 Allowed 'General case' 0 N--CA 1.454 -0.244 0 CA-C-O 121.695 0.76 . . . . 0.0 109.092 171.954 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 5.3 p90 -163.16 20.67 0.08 Allowed 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 127.318 2.247 . . . . 0.0 110.366 179.906 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 19.3 m120 -59.65 -40.91 89.24 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 125.459 1.504 . . . . 0.0 112.755 -169.755 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 25.7 ttt -64.44 -41.76 96.38 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 123.063 0.545 . . . . 0.0 110.226 176.643 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 86.2 mm-40 -89.98 44.89 1.23 Allowed 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 124.124 0.97 . . . . 0.0 109.929 178.784 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 18.7 tp60 -158.43 -46.23 0.06 Allowed 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 123.782 0.833 . . . . 0.0 110.701 -175.363 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 22.6 pt20 -50.48 -35.93 31.35 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.394 1.077 . . . . 0.0 112.653 178.166 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 19.5 tpp85 -71.74 -49.42 39.31 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 124.16 0.984 . . . . 0.0 111.312 -179.522 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 38.6 mtp180 -58.94 -47.49 84.87 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 124.277 1.031 . . . . 0.0 110.078 177.125 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 36.3 t80 -53.25 -55.81 21.55 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 126.694 1.998 . . . . 0.0 110.812 174.577 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 44.7 t80 -54.15 -49.29 69.58 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 123.952 0.901 . . . . 0.0 110.682 177.132 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -56.99 -50.68 71.95 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 123.885 0.874 . . . . 0.0 110.937 -177.404 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.71 -53.03 53.65 Favored 'General case' 0 C--N 1.34 0.17 0 CA-C-O 119.413 -0.327 . . . . 0.0 110.781 178.911 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 9.2 tt -51.13 -45.12 61.52 Favored 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 125.46 1.504 . . . . 0.0 111.175 -178.087 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 15.4 m-70 -75.93 71.51 2.74 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 124.032 0.933 . . . . 0.0 109.562 175.78 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -153.48 141.57 13.9 Favored Pre-proline 0 N--CA 1.453 -0.277 0 C-N-CA 126.464 1.906 . . . . 0.0 106.833 178.191 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_endo -79.77 60.04 7.66 Favored 'Trans proline' 0 N--CA 1.457 -0.655 0 C-N-CA 123.535 2.823 . . . . 0.0 110.359 179.204 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 2.2 t30 66.26 107.09 0.04 OUTLIER 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 127.198 2.199 . . . . 0.0 111.351 177.283 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 75.9 mt -57.12 -65.78 0.56 Allowed 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 123.889 0.876 . . . . 0.0 109.645 178.258 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 43.7 p-10 -159.09 21.39 0.2 Allowed 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 124.199 1.0 . . . . 0.0 111.298 171.912 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 73.8 -52.66 0.69 Allowed 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 126.408 1.883 . . . . 0.0 111.535 -176.986 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -55.4 -68.34 0.2 Allowed 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.944 1.298 . . . . 0.0 110.66 177.958 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 99.9 mm-40 -63.04 -38.56 91.68 Favored 'General case' 0 N--CA 1.457 -0.112 0 C-N-CA 124.2 1.0 . . . . 0.0 110.856 -177.6 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -49.38 -66.3 0.42 Allowed 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 125.044 1.338 . . . . 0.0 110.415 174.239 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 14.4 m-80 -65.43 -38.55 90.24 Favored 'General case' 0 CA--C 1.527 0.082 0 CA-C-O 119.188 -0.434 . . . . 0.0 111.173 -176.668 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -54.36 -47.11 72.97 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 122.931 0.493 . . . . 0.0 111.004 177.78 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 60.1 mttp -59.11 -59.62 5.17 Favored 'General case' 0 C--N 1.342 0.245 0 N-CA-C 109.922 -0.399 . . . . 0.0 109.922 176.602 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 28.4 mm -50.52 -47.07 27.58 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.433 0 C-N-CA 123.794 0.838 . . . . 0.0 111.428 -175.76 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -66.78 -53.4 33.35 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 123.658 0.783 . . . . 0.0 111.607 -179.111 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 89.2 p -60.44 -41.15 93.47 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 123.082 0.553 . . . . 0.0 112.073 -176.738 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 68.0 mt -57.44 -44.42 84.52 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.18 0 C-N-CA 124.759 1.224 . . . . 0.0 110.259 176.073 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 73.6 mtm180 -79.98 57.21 2.57 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 123.273 0.629 . . . . 0.0 110.942 177.255 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 24.9 p-10 -99.36 -52.53 3.48 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 125.009 1.324 . . . . 0.0 109.764 171.094 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 . . . . . 0 C--O 1.251 1.134 0 C-N-CA 125.324 1.449 . . . . 0.0 109.684 177.165 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 34.7 mt-30 . . . . . 0 N--CA 1.453 -0.297 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -151.08 -49.03 0.12 Allowed 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 125.221 1.408 . . . . 0.0 110.28 178.869 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 15.6 tpt180 -58.85 -36.91 75.35 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 123.124 0.57 . . . . 0.0 111.376 176.516 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -62.13 -49.28 76.51 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 123.065 0.546 . . . . 0.0 110.289 -179.685 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 85.8 m-85 -60.24 -46.09 90.99 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 123.263 0.625 . . . . 0.0 110.991 177.565 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 46.9 t80 -54.96 -48.3 73.37 Favored 'General case' 0 C--N 1.341 0.197 0 C-N-CA 122.934 0.494 . . . . 0.0 110.699 175.475 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -63.48 -46.66 85.17 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 122.709 0.404 . . . . 0.0 110.553 -176.598 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.04 -39.81 95.85 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 124.002 0.921 . . . . 0.0 111.824 178.903 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 66.9 tp -69.02 -48.6 62.56 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 123.515 0.726 . . . . 0.0 110.238 179.148 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 17.3 m-70 -81.84 61.77 5.34 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.292 1.037 . . . . 0.0 109.164 177.631 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 62.1 t0 -146.63 82.62 8.65 Favored Pre-proline 0 CA--C 1.533 0.319 0 C-N-CA 124.886 1.274 . . . . 0.0 108.022 179.33 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -69.09 -25.18 31.94 Favored 'Trans proline' 0 N--CA 1.455 -0.748 0 C-N-CA 123.093 2.529 . . . . 0.0 112.082 -177.346 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 17.8 m-80 -54.28 -48.97 70.65 Favored 'General case' 0 C--N 1.342 0.246 0 C-N-CA 124.248 1.019 . . . . 0.0 109.937 177.998 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -72.24 118.71 15.46 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 107.145 -1.428 . . . . 0.0 107.145 170.124 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 7.0 p-10 -66.68 160.37 25.72 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 123.504 0.722 . . . . 0.0 110.475 178.016 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -75.18 72.6 2.28 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.103 0.961 . . . . 0.0 111.115 -175.252 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.3 tp10 -171.62 -51.22 0.02 OUTLIER 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 127.139 2.175 . . . . 0.0 106.992 175.344 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 36.1 mm-40 -71.15 -45.48 63.45 Favored 'General case' 0 CA--C 1.53 0.184 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 170.51 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 27.6 ttm180 -52.46 -49.12 65.3 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 124.645 1.178 . . . . 0.0 109.926 170.978 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 50.7 t30 -61.42 -42.31 98.54 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.557 0.743 . . . . 0.0 110.783 178.994 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.67 -40.76 88.83 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 122.883 0.473 . . . . 0.0 111.425 177.218 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 62.6 mtpt -59.22 -47.33 85.75 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 118.375 0.534 . . . . 0.0 110.722 175.478 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 33.1 mm -56.78 -53.21 44.94 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.267 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 176.258 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 58.9 mttp -79.3 55.01 1.8 Allowed 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 125.308 1.443 . . . . 0.0 110.376 177.526 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 44.5 t -165.98 -48.63 0.03 OUTLIER 'General case' 0 N--CA 1.456 -0.155 0 C-N-CA 125.625 1.57 . . . . 0.0 108.178 -179.56 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 72.2 mt -54.79 -43.57 67.7 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 171.273 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 13.3 ptp180 -73.33 -49.38 27.74 Favored 'General case' 0 C--N 1.342 0.277 0 CA-C-N 117.982 0.355 . . . . 0.0 111.411 171.243 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 28.2 t70 . . . . . 0 N--CA 1.454 -0.237 0 C-N-CA 124.016 0.926 . . . . 0.0 110.002 -173.616 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 37.0 tt0 . . . . . 0 N--CA 1.452 -0.339 0 N-CA-C 111.605 0.224 . . . . 0.0 111.605 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 -57.61 -42.29 82.97 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 123.403 0.681 . . . . 0.0 110.173 172.76 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 6.4 mmp_? -65.91 -32.19 73.55 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-O 118.834 -0.603 . . . . 0.0 112.16 175.267 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 16.7 mmm180 -65.1 -47.59 76.65 Favored 'General case' 0 C--N 1.341 0.232 0 CA-C-N 119.09 0.859 . . . . 0.0 110.836 175.606 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 47.7 m-85 -59.4 -56.11 26.21 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 122.668 0.387 . . . . 0.0 110.751 175.575 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 70.8 t80 -48.03 -52.28 20.66 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 125.626 1.57 . . . . 0.0 110.8 179.138 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 4.4 tm-20 -53.57 -57.9 9.1 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.826 1.25 . . . . 0.0 110.409 175.91 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -53.49 -44.04 68.7 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 124.006 0.922 . . . . 0.0 112.435 -177.866 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 7.1 mp -61.35 -54.32 45.28 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 124.102 0.961 . . . . 0.0 111.283 179.519 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 32.5 m-70 -76.55 -48.14 20.32 Favored 'General case' 0 N--CA 1.457 -0.124 0 N-CA-C 113.046 0.758 . . . . 0.0 113.046 -169.908 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -54.78 113.92 6.1 Favored Pre-proline 0 CA--C 1.535 0.392 0 C-N-CA 124.238 1.015 . . . . 0.0 111.709 -174.288 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -54.95 -40.87 83.59 Favored 'Trans proline' 0 C--N 1.348 0.525 0 C-N-CA 123.481 2.787 . . . . 0.0 112.177 174.34 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 5.0 p30 -57.08 -36.36 70.48 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 123.95 0.9 . . . . 0.0 111.443 177.688 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -80.09 70.74 6.75 Favored 'General case' 0 C--N 1.343 0.31 0 N-CA-C 106.723 -1.584 . . . . 0.0 106.723 169.305 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 8.5 p30 -65.95 168.53 8.0 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 125.208 1.403 . . . . 0.0 110.368 177.415 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -34.59 -64.01 0.27 Allowed 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 126.108 1.763 . . . . 0.0 114.38 -169.95 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -60.6 -38.64 85.33 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 -176.736 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 25.4 mm100 -70.24 -41.26 73.79 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 123.43 0.692 . . . . 0.0 110.807 179.421 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 64.4 ttp85 -60.47 -45.52 93.43 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 124.388 1.075 . . . . 0.0 110.09 175.538 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 4.6 m-80 -62.06 -40.2 94.98 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 122.885 0.474 . . . . 0.0 110.796 175.889 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -62.04 -44.16 97.29 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 118.228 0.467 . . . . 0.0 111.349 176.292 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 10.5 mmmm -57.15 -55.87 29.1 Favored 'General case' 0 C--N 1.342 0.273 0 C-N-CA 123.074 0.549 . . . . 0.0 109.909 174.401 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 75.2 mt -52.66 -48.84 47.75 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.298 0 C-N-CA 123.714 0.806 . . . . 0.0 110.837 -179.887 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 66.5 tttm -60.99 -49.86 75.72 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 123.925 0.89 . . . . 0.0 111.296 -178.728 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 78.6 p -64.77 -41.04 96.18 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 123.2 0.6 . . . . 0.0 111.741 -178.328 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 72.4 mt -59.47 -45.1 94.01 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 C-N-CA 123.543 0.737 . . . . 0.0 109.326 173.48 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 54.0 ttp180 -78.23 58.82 2.14 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 125.139 1.376 . . . . 0.0 109.839 176.813 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 27.7 t70 . . . . . 0 N--CA 1.455 -0.214 0 C-N-CA 124.237 1.015 . . . . 0.0 110.439 179.645 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 . . . . . 0 N--CA 1.45 -0.439 0 N-CA-C 108.032 -1.099 . . . . 0.0 108.032 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 15.3 tp60 -154.45 -58.86 0.11 Allowed 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 108.075 -1.083 . . . . 0.0 108.075 179.457 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 3.4 tpm_? -60.66 -45.31 94.6 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 170.105 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 94.8 mtt-85 -54.8 -52.24 63.26 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 124.745 1.218 . . . . 0.0 110.639 177.129 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 21.1 m-85 -59.2 -44.03 92.24 Favored 'General case' 0 C--N 1.34 0.183 0 CA-C-O 119.085 -0.483 . . . . 0.0 111.426 177.789 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 49.3 t80 -59.66 -51.62 69.0 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 118.468 0.576 . . . . 0.0 110.578 178.797 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -55.89 -42.83 76.54 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 123.563 0.745 . . . . 0.0 110.998 179.409 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.77 -57.52 9.69 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.268 0.627 . . . . 0.0 111.576 178.512 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 72.6 mt -60.08 -53.64 55.35 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 124.467 1.107 . . . . 0.0 111.401 -176.481 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 36.6 m-70 -82.64 64.35 7.23 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.156 0.982 . . . . 0.0 109.217 -177.148 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 36.9 t0 -134.32 87.18 33.77 Favored Pre-proline 0 CA--C 1.533 0.301 0 C-N-CA 125.31 1.444 . . . . 0.0 107.949 179.77 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 96.1 Cg_exo -48.01 -43.59 29.89 Favored 'Trans proline' 0 N--CA 1.459 -0.555 0 C-N-CA 124.757 3.638 . . . . 0.0 113.885 -179.12 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 20.3 m120 -60.47 -48.84 80.0 Favored 'General case' 0 CA--C 1.529 0.141 0 C-N-CA 124.04 0.936 . . . . 0.0 111.442 -176.897 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 10.4 mp -75.57 133.28 40.99 Favored 'General case' 0 N--CA 1.456 -0.172 0 C-N-CA 122.938 0.495 . . . . 0.0 109.961 -179.162 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 20.5 p30 -79.41 177.26 8.99 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.517 0.727 . . . . 0.0 111.047 178.414 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -51.55 -48.4 63.09 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 124.432 1.093 . . . . 0.0 112.271 -178.026 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 13.8 tp10 -64.86 -42.87 94.5 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 122.933 0.493 . . . . 0.0 111.173 -178.078 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 65.9 mt-30 -62.36 -41.76 98.86 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 122.863 0.465 . . . . 0.0 110.837 177.735 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 95.5 mtt180 -60.3 -50.73 72.49 Favored 'General case' 0 C--O 1.225 -0.192 0 C-N-CA 122.887 0.475 . . . . 0.0 109.897 174.529 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 78.9 m-20 -53.25 -45.13 68.67 Favored 'General case' 0 C--N 1.341 0.208 0 C-N-CA 123.598 0.759 . . . . 0.0 111.088 178.216 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.75 -43.31 90.25 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 123.559 0.743 . . . . 0.0 111.108 176.734 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 79.2 mttt -59.36 -49.77 76.53 Favored 'General case' 0 C--N 1.341 0.235 0 CA-C-O 118.231 -0.89 . . . . 0.0 111.077 173.359 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 8.3 mm -56.73 -47.58 82.34 Favored 'Isoleucine or valine' 0 C--N 1.343 0.303 0 CA-C-N 119.418 1.008 . . . . 0.0 109.738 -178.337 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 27.3 ttpp -56.63 -45.74 81.37 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.255 1.022 . . . . 0.0 111.63 177.876 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 23.1 t -62.3 -47.44 84.28 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 123.298 0.639 . . . . 0.0 111.009 178.703 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 60.3 mt -60.82 -38.31 78.67 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 C-N-CA 125.005 1.322 . . . . 0.0 110.158 178.72 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 2.4 mmp_? -65.45 -1.04 2.21 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 124.999 1.319 . . . . 0.0 114.345 178.241 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 28.2 t70 . . . . . 0 CA--C 1.534 0.345 0 C-N-CA 123.458 0.703 . . . . 0.0 111.518 173.178 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 35.8 mt-30 . . . . . 0 CA--C 1.534 0.338 0 CA-C-O 118.899 -0.572 . . . . 0.0 111.55 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 20.8 tm0? -53.72 -36.97 62.84 Favored 'General case' 0 C--N 1.343 0.314 0 C-N-CA 124.46 1.104 . . . . 0.0 110.131 174.795 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 3.3 mpt_? -63.35 -54.91 29.45 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 123.897 0.879 . . . . 0.0 109.739 179.334 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 19.7 mmm180 -58.58 -47.92 82.67 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 124.04 0.936 . . . . 0.0 110.284 -178.257 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 26.8 t80 -54.55 -48.76 71.65 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 127.367 2.267 . . . . 0.0 111.646 175.874 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 79.7 t80 -65.0 -45.2 86.57 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 124.886 1.274 . . . . 0.0 110.967 -179.573 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -56.46 -51.95 66.51 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.339 0.656 . . . . 0.0 110.081 174.661 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.05 -41.44 87.9 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 124.102 0.961 . . . . 0.0 111.68 179.413 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 49.9 tp -58.56 -46.1 87.58 Favored 'General case' 0 C--N 1.339 0.14 0 C-N-CA 123.759 0.823 . . . . 0.0 110.137 177.643 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 23.0 m-70 -96.67 55.08 1.37 Allowed 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 123.981 0.912 . . . . 0.0 110.148 -178.415 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -142.28 89.17 8.67 Favored Pre-proline 0 CA--C 1.533 0.302 0 C-N-CA 123.816 0.846 . . . . 0.0 109.656 179.346 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_exo -53.48 -30.2 52.8 Favored 'Trans proline' 0 N--CA 1.458 -0.56 0 C-N-CA 124.397 3.398 . . . . 0.0 113.84 175.846 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 11.9 m120 -52.81 -47.71 67.45 Favored 'General case' 0 C--N 1.343 0.316 0 C-N-CA 124.294 1.038 . . . . 0.0 110.707 179.52 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 46.4 mt -69.14 118.45 12.05 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 107.061 -1.459 . . . . 0.0 107.061 169.555 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 12.7 p30 -61.75 156.57 19.99 Favored 'General case' 0 CA--C 1.529 0.155 0 C-N-CA 123.193 0.597 . . . . 0.0 110.96 -178.382 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 9.6 mp0 -47.78 -50.97 24.1 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 125.181 1.393 . . . . 0.0 111.995 -175.778 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -58.37 -59.99 4.49 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 123.104 0.561 . . . . 0.0 111.028 -175.22 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 29.5 mm100 -62.65 -45.56 92.25 Favored 'General case' 0 CA--C 1.529 0.155 0 C-N-CA 123.23 0.612 . . . . 0.0 111.123 -177.405 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 41.2 ttp180 -56.39 -58.93 5.92 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 123.996 0.918 . . . . 0.0 110.372 179.9 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 62.3 m-20 -62.47 -35.27 78.79 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 123.563 0.745 . . . . 0.0 111.343 -176.752 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -62.52 -48.92 77.42 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 122.811 0.444 . . . . 0.0 110.868 175.232 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 59.6 mtpt -59.97 -46.82 88.18 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 123.603 0.761 . . . . 0.0 110.823 178.579 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 24.9 mm -54.41 -57.45 6.18 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.261 0 C-N-CA 123.708 0.803 . . . . 0.0 109.658 174.891 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 82.0 tttt -80.47 59.2 3.42 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.598 1.159 . . . . 0.0 109.787 178.66 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 46.5 t -168.86 -46.32 0.02 OUTLIER 'General case' 0 N--CA 1.456 -0.174 0 C-N-CA 126.507 1.923 . . . . 0.0 107.929 179.824 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 53.2 mt -53.12 -54.21 18.49 Favored 'Isoleucine or valine' 0 C--N 1.342 0.277 0 C-N-CA 123.717 0.807 . . . . 0.0 109.075 169.992 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 9.8 ptp180 -82.28 64.4 6.92 Favored 'General case' 0 C--N 1.342 0.248 0 CA-C-O 121.069 0.461 . . . . 0.0 111.216 175.749 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 . . . . . 0 CA--C 1.533 0.299 0 C-N-CA 123.474 0.71 . . . . 0.0 109.613 169.816 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 80.5 mt-30 . . . . . 0 N--CA 1.453 -0.317 0 CA-C-O 117.903 -1.046 . . . . 0.0 113.553 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 -51.68 -39.06 57.56 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 120.286 1.403 . . . . 0.0 111.451 175.535 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 25.6 mmm180 -56.32 -65.96 0.52 Allowed 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 124.079 0.952 . . . . 0.0 110.778 175.794 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 58.2 mtp180 -50.5 -43.56 55.67 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 125.234 1.413 . . . . 0.0 111.561 178.812 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 80.9 t80 -61.04 -53.8 52.69 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 126.919 2.087 . . . . 0.0 111.695 -177.239 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -72.02 -32.59 67.29 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 118.468 0.576 . . . . 0.0 111.171 -179.75 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 25.5 mm-40 -61.46 -42.39 98.7 Favored 'General case' 0 CA--C 1.532 0.269 0 O-C-N 121.628 -0.67 . . . . 0.0 110.182 172.763 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.35 -47.93 83.64 Favored 'General case' 0 N--CA 1.456 -0.172 0 C-N-CA 123.198 0.599 . . . . 0.0 110.483 176.191 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 34.1 tp -50.6 -44.47 57.04 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.682 1.193 . . . . 0.0 110.991 175.419 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 28.1 m170 -78.54 -40.21 35.62 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 123.751 0.82 . . . . 0.0 113.188 -174.113 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.31 140.89 94.48 Favored Pre-proline 0 CA--C 1.537 0.446 0 CA-C-N 119.056 0.844 . . . . 0.0 111.36 -170.011 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_endo -78.86 -37.83 0.55 Allowed 'Trans proline' 0 N--CA 1.455 -0.78 0 C-N-CA 123.289 2.659 . . . . 0.0 112.43 -178.032 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 3.4 p-10 -58.14 -40.85 82.37 Favored 'General case' 0 C--N 1.341 0.23 0 N-CA-C 113.798 1.036 . . . . 0.0 113.798 -169.808 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 68.2 mt -70.3 117.91 12.45 Favored 'General case' 0 N--CA 1.455 -0.186 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 173.019 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 32.9 p-10 -73.1 176.65 5.63 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 123.376 0.67 . . . . 0.0 110.73 178.779 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.9 mp0 -81.54 55.82 2.77 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 123.645 0.778 . . . . 0.0 109.953 179.507 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 56.5 mt-10 -147.17 -60.92 0.28 Allowed 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 126.881 2.072 . . . . 0.0 105.958 169.974 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 37.2 mm-40 -67.81 -44.08 78.14 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 123.892 0.877 . . . . 0.0 110.439 178.709 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 20.1 ttm180 -58.63 -55.96 28.38 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 123.072 0.549 . . . . 0.0 109.634 177.846 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 22.9 m120 -62.07 -37.91 86.82 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-O 119.158 -0.449 . . . . 0.0 111.374 -177.325 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.3 -48.72 80.58 Favored 'General case' 0 C--N 1.341 0.21 0 CA-C-N 118.239 0.472 . . . . 0.0 110.935 175.906 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 25.0 mmtp -56.73 -56.86 16.13 Favored 'General case' 0 C--N 1.341 0.203 0 C-N-CA 123.127 0.571 . . . . 0.0 110.338 176.421 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 23.1 mm -50.98 -57.74 2.53 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.235 0 C-N-CA 123.948 0.899 . . . . 0.0 110.408 -179.151 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -53.28 -50.38 64.98 Favored 'General case' 0 N--CA 1.456 -0.164 0 C-N-CA 125.065 1.346 . . . . 0.0 111.044 -179.134 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 35.4 t -58.33 -46.26 86.56 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.694 0.798 . . . . 0.0 111.492 -179.09 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 59.6 mt -65.8 -50.13 72.7 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 C-N-CA 123.008 0.523 . . . . 0.0 110.558 -175.875 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 18.5 ptp180 -66.51 -33.72 76.32 Favored 'General case' 0 C--N 1.342 0.272 0 CA-C-N 118.223 0.465 . . . . 0.0 112.044 179.149 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 37.3 t70 . . . . . 0 CA--C 1.531 0.231 0 N-CA-C 108.5 -0.926 . . . . 0.0 108.5 171.881 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 17.6 tt0 . . . . . 0 CA--C 1.534 0.337 0 CA-C-O 120.964 0.412 . . . . 0.0 110.725 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 19.1 tp60 -163.54 -56.91 0.04 OUTLIER 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 124.435 1.094 . . . . 0.0 110.059 179.288 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 30.9 tpt180 -72.39 -77.98 0.09 Allowed 'General case' 0 C--N 1.341 0.227 0 C-N-CA 122.854 0.461 . . . . 0.0 110.895 -172.701 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.77 -26.83 66.03 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 122.672 0.389 . . . . 0.0 111.562 178.733 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 76.3 t80 -61.22 -56.66 18.12 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 126.425 1.89 . . . . 0.0 110.514 175.486 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 55.7 t80 -58.47 -49.64 76.63 Favored 'General case' 0 C--N 1.341 0.207 0 C-N-CA 122.649 0.38 . . . . 0.0 110.215 176.79 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -56.89 -44.73 82.61 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 122.838 0.455 . . . . 0.0 111.451 -177.827 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.95 -53.87 52.76 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 123.589 0.755 . . . . 0.0 111.49 179.719 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 55.1 tp -63.45 -52.67 60.43 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 122.766 0.426 . . . . 0.0 110.554 -178.991 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 24.8 m-70 -81.43 64.39 6.13 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 124.465 1.106 . . . . 0.0 109.696 -179.084 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -150.82 115.25 3.22 Favored Pre-proline 0 CA--C 1.533 0.302 0 C-N-CA 124.89 1.276 . . . . 0.0 108.181 175.853 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 94.4 Cg_endo -77.82 -25.11 8.01 Favored 'Trans proline' 0 N--CA 1.455 -0.754 0 C-N-CA 123.249 2.633 . . . . 0.0 112.052 -177.85 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 -56.13 -55.18 36.18 Favored 'General case' 0 C--N 1.342 0.265 0 C-N-CA 123.775 0.83 . . . . 0.0 110.619 -178.796 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 91.0 mt -79.41 141.37 36.9 Favored 'General case' 0 N--CA 1.453 -0.28 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 172.64 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 43.8 p-10 -96.68 176.51 5.98 Favored 'General case' 0 C--O 1.233 0.189 0 C-N-CA 124.493 1.117 . . . . 0.0 110.396 179.485 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -79.37 62.4 3.7 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 124.123 0.969 . . . . 0.0 110.453 175.514 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 64.8 mt-10 -148.2 -47.27 0.16 Allowed 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 127.18 2.192 . . . . 0.0 106.794 169.773 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 22.9 mm100 -80.34 -56.65 4.05 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 124.063 0.945 . . . . 0.0 109.71 173.365 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 21.7 ptt180 -68.0 -41.83 81.66 Favored 'General case' 0 C--N 1.341 0.23 0 CA-C-O 119.526 -0.273 . . . . 0.0 111.151 -173.722 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 43.2 p-10 -62.93 -35.81 81.32 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 117.951 0.341 . . . . 0.0 111.622 -178.112 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -60.73 -44.81 96.18 Favored 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 123.687 0.795 . . . . 0.0 110.567 175.199 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 57.0 mtmt -61.44 -48.91 79.0 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-O 119.423 -0.322 . . . . 0.0 110.712 175.729 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 27.9 mm -55.93 -45.02 79.86 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 C-N-CA 124.056 0.942 . . . . 0.0 111.326 179.294 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 88.6 mttt -61.5 -47.43 85.68 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 123.704 0.801 . . . . 0.0 110.689 175.425 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 23.1 t -61.92 -43.57 98.57 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 123.915 0.886 . . . . 0.0 112.012 -177.589 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 58.4 mt -61.59 -35.58 68.0 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.222 0 C-N-CA 124.102 0.961 . . . . 0.0 109.905 177.401 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 85.3 mtm180 -78.31 52.59 1.15 Allowed 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.27 0.628 . . . . 0.0 111.479 173.248 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 . . . . . 0 CA--C 1.532 0.273 0 C-N-CA 124.491 1.116 . . . . 0.0 109.445 169.579 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 26.8 mt-30 . . . . . 0 CA--C 1.536 0.407 0 N-CA-C 112.061 0.393 . . . . 0.0 112.061 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 11.9 tp-100 -66.38 -46.08 77.87 Favored 'General case' 0 C--N 1.341 0.23 0 CA-C-N 118.944 0.793 . . . . 0.0 110.042 179.638 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 9.1 mmm180 -58.4 -36.59 73.79 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.785 0.834 . . . . 0.0 111.426 173.042 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 12.0 mmp_? -68.52 -37.22 79.84 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 123.581 0.753 . . . . 0.0 110.534 179.634 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 15.6 m-30 -65.29 -48.86 71.67 Favored 'General case' 0 N--CA 1.455 -0.196 0 CA-C-O 119.428 -0.32 . . . . 0.0 110.157 172.198 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 21.3 m-85 -79.39 60.27 3.12 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 123.904 0.882 . . . . 0.0 109.987 175.716 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.7 tm-20 -175.57 -50.33 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 127.182 2.193 . . . . 0.0 106.99 -174.996 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -73.8 -53.03 11.18 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 124.179 0.992 . . . . 0.0 110.896 175.856 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 58.5 tp -73.4 -54.89 7.22 Favored 'General case' 0 C--N 1.34 0.166 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 175.157 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 56.0 m-70 -84.01 59.78 5.48 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 123.423 0.689 . . . . 0.0 109.696 178.898 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -94.57 137.62 22.53 Favored Pre-proline 0 CA--C 1.533 0.322 0 C-N-CA 124.439 1.096 . . . . 0.0 108.239 174.531 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_exo -42.43 -52.94 4.01 Favored 'Trans proline' 0 N--CA 1.458 -0.59 0 C-N-CA 124.004 3.136 . . . . 0.0 114.136 173.954 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 5.9 p-10 -160.31 131.94 5.95 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 123.621 0.768 . . . . 0.0 110.54 -179.573 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 92.8 mt -140.5 -126.95 0.11 Allowed 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 125.4 1.48 . . . . 0.0 107.104 172.704 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 51.6 p-10 -155.07 23.58 0.43 Allowed 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.768 0.827 . . . . 0.0 111.957 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 74.17 -54.28 0.68 Allowed 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 125.91 1.684 . . . . 0.0 112.109 -177.47 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -52.58 -59.64 4.22 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 124.465 1.106 . . . . 0.0 110.24 178.067 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 83.8 mt-30 -58.82 -43.31 90.57 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 124.803 1.241 . . . . 0.0 110.897 178.652 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 59.2 ttm-85 -55.51 -54.98 37.13 Favored 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 124.807 1.243 . . . . 0.0 111.218 -177.502 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 28.8 m-80 -71.23 -38.16 71.99 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 123.061 0.544 . . . . 0.0 111.146 179.804 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.19 -43.74 87.69 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 118.434 0.561 . . . . 0.0 111.233 177.954 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 58.6 mtpt -59.59 -50.99 71.76 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 123.129 0.571 . . . . 0.0 109.929 175.709 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 11.6 mm -52.99 -51.75 35.23 Favored 'Isoleucine or valine' 0 C--N 1.341 0.226 0 C-N-CA 123.019 0.527 . . . . 0.0 111.045 178.963 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 67.6 mttm -57.68 -49.63 75.85 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 123.527 0.731 . . . . 0.0 110.878 179.683 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 32.5 t -57.77 -51.29 70.16 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 124.072 0.949 . . . . 0.0 111.472 -179.119 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 67.1 mt -58.97 -58.26 7.66 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.223 0 C-N-CA 124.765 1.226 . . . . 0.0 109.435 179.722 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 61.1 ttm-85 -55.44 -42.28 73.99 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 125.136 1.374 . . . . 0.0 111.39 -175.721 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 37.9 t70 . . . . . 0 CA--C 1.534 0.343 0 C-N-CA 123.957 0.903 . . . . 0.0 109.249 172.762 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 17.4 mm100 . . . . . 0 C--O 1.225 -0.228 0 CA-C-O 119.092 -0.48 . . . . 0.0 110.747 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 16.1 mm100 -67.3 -38.64 85.32 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 123.753 0.821 . . . . 0.0 111.447 -177.188 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 4.0 tmt_? -62.84 -54.95 30.93 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 124.432 1.093 . . . . 0.0 110.265 176.531 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 89.4 mtt-85 -67.56 -32.73 73.7 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 124.067 0.947 . . . . 0.0 111.185 -177.144 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 3.5 t80 -56.98 -53.79 54.06 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 125.275 1.43 . . . . 0.0 110.294 169.953 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 70.9 t80 -57.42 -48.06 80.13 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 123.377 0.671 . . . . 0.0 110.724 179.747 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 73.2 mt-10 -56.13 -50.02 72.28 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 123.119 0.568 . . . . 0.0 111.077 175.791 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -56.81 -45.09 82.49 Favored 'General case' 0 C--N 1.341 0.207 0 C-N-CA 124.138 0.975 . . . . 0.0 111.462 179.97 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 1.1 tt -50.8 -41.26 57.05 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 124.454 1.102 . . . . 0.0 109.95 175.01 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 11.9 m-70 -100.52 25.64 7.53 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 124.437 1.095 . . . . 0.0 112.678 -176.169 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 80.0 m-20 -69.05 151.98 96.97 Favored Pre-proline 0 CA--C 1.538 0.486 0 CA-C-N 119.13 0.877 . . . . 0.0 109.946 174.884 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_exo -50.75 -63.64 0.27 Allowed 'Trans proline' 0 C--N 1.351 0.663 0 C-N-CA 123.962 3.108 . . . . 0.0 114.46 -173.831 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 -162.96 84.61 0.52 Allowed 'General case' 0 N--CA 1.456 -0.141 0 C-N-CA 123.189 0.596 . . . . 0.0 109.572 -176.077 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 89.6 mt -122.94 129.24 51.33 Favored 'General case' 0 N--CA 1.456 -0.135 0 N-CA-C 106.267 -1.753 . . . . 0.0 106.267 172.747 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 1.7 p30 -69.24 163.93 23.88 Favored 'General case' 0 CA--C 1.529 0.157 0 N-CA-C 112.883 0.697 . . . . 0.0 112.883 -169.533 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 -58.02 -28.52 64.52 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 124.372 1.069 . . . . 0.0 113.074 -172.002 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -57.64 -50.29 73.66 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 119.069 0.849 . . . . 0.0 109.902 173.903 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 47.5 mt-30 -65.39 -40.13 93.07 Favored 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 124.278 1.031 . . . . 0.0 110.378 -179.885 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 5.8 mmp_? -62.25 -65.0 0.75 Allowed 'General case' 0 C--N 1.342 0.257 0 N-CA-C 109.244 -0.651 . . . . 0.0 109.244 177.896 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 61.2 t30 -50.14 -38.7 40.47 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 124.909 1.284 . . . . 0.0 112.368 -176.986 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -54.6 -49.25 70.91 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 118.297 0.499 . . . . 0.0 111.103 174.013 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 95.5 mttt -62.54 -55.87 23.35 Favored 'General case' 0 C--N 1.342 0.241 0 CA-C-O 118.938 -0.553 . . . . 0.0 110.807 173.831 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 4.9 mm -57.73 -37.96 62.4 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 CA-C-N 118.294 0.497 . . . . 0.0 110.499 -171.056 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 17.6 tppt? -60.2 -50.98 71.51 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 124.265 1.026 . . . . 0.0 110.453 176.701 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 18.1 m -59.55 -44.96 93.09 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.59 0.756 . . . . 0.0 111.037 179.067 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 48.8 mt -62.69 -47.72 91.57 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 C-N-CA 125.386 1.474 . . . . 0.0 110.226 -179.347 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 78.4 mtm180 -56.91 -46.53 81.92 Favored 'General case' 0 C--N 1.34 0.193 0 C-N-CA 123.77 0.828 . . . . 0.0 110.282 174.325 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 53.0 m-20 . . . . . 0 CA--C 1.535 0.381 0 C-N-CA 123.773 0.829 . . . . 0.0 110.992 -178.846 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 16.6 mm100 . . . . . 0 CA--C 1.53 0.203 0 N-CA-C 110.557 -0.164 . . . . 0.0 110.557 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 62.0 mm-40 -59.35 -39.57 83.62 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 124.015 0.926 . . . . 0.0 111.63 179.25 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 9.7 mmm180 -58.95 -56.91 16.11 Favored 'General case' 0 N--CA 1.456 -0.167 0 CA-C-N 118.143 0.428 . . . . 0.0 110.909 176.406 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 19.8 ptt180 -66.07 -30.69 71.25 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 112.557 0.577 . . . . 0.0 112.557 -177.582 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 15.5 m-85 -58.69 -52.01 67.52 Favored 'General case' 0 C--N 1.343 0.311 0 CA-C-N 118.494 0.588 . . . . 0.0 110.344 169.874 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 47.5 t80 -58.37 -48.65 79.94 Favored 'General case' 0 C--N 1.341 0.203 0 C-N-CA 122.994 0.517 . . . . 0.0 110.657 -179.807 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -56.99 -46.99 81.87 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 123.355 0.662 . . . . 0.0 111.03 -179.742 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.62 -54.09 44.82 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 123.402 0.681 . . . . 0.0 111.514 178.716 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 61.3 tp -59.86 -45.77 91.39 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 124.572 1.149 . . . . 0.0 111.215 -176.428 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 22.9 m-70 -89.28 16.24 7.71 Favored 'General case' 0 CA--C 1.537 0.481 0 C-N-CA 124.309 1.043 . . . . 0.0 111.994 -179.617 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -68.22 135.45 91.33 Favored Pre-proline 0 CA--C 1.533 0.311 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 172.863 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -67.67 -29.16 36.61 Favored 'Trans proline' 0 N--CA 1.457 -0.651 0 C-N-CA 122.456 2.104 . . . . 0.0 112.668 -176.39 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 27.5 m-80 -83.1 62.88 6.84 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.685 0.794 . . . . 0.0 110.516 -175.884 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 20.7 mt -80.3 87.1 5.6 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-O 121.683 0.754 . . . . 0.0 110.234 177.794 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 52.3 p-10 -98.7 17.36 19.47 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 125.602 1.561 . . . . 0.0 110.775 171.413 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.9 mp0 71.46 -55.98 0.64 Allowed 'General case' 0 C--N 1.345 0.408 0 C-N-CA 127.223 2.209 . . . . 0.0 111.277 -174.035 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -45.24 -54.03 7.55 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 126.246 1.819 . . . . 0.0 112.219 -178.191 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 37.1 mt-30 -60.52 -54.13 49.15 Favored 'General case' 0 C--N 1.34 0.176 0 C-N-CA 123.301 0.641 . . . . 0.0 110.56 -176.34 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 78.3 ttt180 -54.33 -56.19 20.99 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 124.117 0.967 . . . . 0.0 110.998 -179.253 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 11.4 m-80 -59.74 -50.3 74.38 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 122.939 0.495 . . . . 0.0 110.854 -177.537 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -54.64 -50.21 68.69 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 123.262 0.625 . . . . 0.0 111.409 -179.828 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 27.1 mmmt -61.39 -54.02 49.1 Favored 'General case' 0 N--CA 1.454 -0.225 0 C-N-CA 122.769 0.428 . . . . 0.0 110.83 179.603 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 39.7 mt -54.87 -46.53 75.68 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 C-N-CA 123.282 0.633 . . . . 0.0 110.999 -178.159 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 60.9 mtpt -58.16 -48.25 80.85 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 123.888 0.875 . . . . 0.0 110.972 176.227 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 50.3 m -58.29 -52.7 64.49 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 117.917 0.326 . . . . 0.0 111.121 179.13 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 41.1 mt -63.37 -49.06 84.38 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.251 0 C-N-CA 124.312 1.045 . . . . 0.0 110.751 -173.891 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 12.3 ptm180 -64.81 -34.79 79.2 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 118.018 0.372 . . . . 0.0 111.634 -177.087 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 84.1 m-20 . . . . . 0 C--N 1.341 0.237 0 C-N-CA 122.761 0.424 . . . . 0.0 110.235 175.539 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 90.0 mt-30 . . . . . 0 N--CA 1.453 -0.304 0 CA-C-O 118.921 -0.562 . . . . 0.0 112.154 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 11.5 tt0 -60.23 -32.56 71.24 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 118.876 0.762 . . . . 0.0 111.398 177.254 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 5.1 mmp_? -64.14 -47.02 81.53 Favored 'General case' 0 N--CA 1.456 -0.151 0 C-N-CA 123.245 0.618 . . . . 0.0 110.12 173.858 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 79.4 mtt85 -60.49 -44.33 96.07 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 123.42 0.688 . . . . 0.0 110.139 178.151 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 14.1 m-30 -57.67 -45.71 85.23 Favored 'General case' 0 C--O 1.225 -0.215 0 C-N-CA 123.562 0.745 . . . . 0.0 111.592 174.982 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 87.0 t80 -58.43 -52.27 66.34 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 118.648 0.658 . . . . 0.0 110.373 178.795 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -56.9 -52.41 65.25 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.564 0.746 . . . . 0.0 111.178 179.841 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.23 -51.13 70.87 Favored 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 124.739 1.216 . . . . 0.0 111.555 -178.004 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 59.6 tp -62.11 -50.2 72.87 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 124.541 1.136 . . . . 0.0 110.34 -177.548 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 18.0 m-70 -82.17 62.78 6.06 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.8 0.84 . . . . 0.0 109.674 178.008 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -154.43 121.93 2.89 Favored Pre-proline 0 CA--C 1.535 0.371 0 C-N-CA 123.916 0.886 . . . . 0.0 109.414 176.491 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo -80.06 -32.75 1.31 Allowed 'Trans proline' 0 N--CA 1.456 -0.735 0 C-N-CA 123.458 2.772 . . . . 0.0 112.319 -178.311 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 30.3 t30 -53.52 -47.88 69.52 Favored 'General case' 0 C--N 1.343 0.298 0 C-N-CA 124.231 1.012 . . . . 0.0 110.923 -176.246 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -75.87 88.51 2.88 Favored 'General case' 0 N--CA 1.455 -0.219 0 N-CA-C 105.272 -2.121 . . . . 0.0 105.272 169.5 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 -81.69 55.45 2.7 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.532 1.133 . . . . 0.0 112.811 -169.639 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 15.3 tt0 69.88 164.94 0.27 Allowed 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.879 1.272 . . . . 0.0 110.969 -179.353 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.9 tp10 71.8 -64.01 0.4 Allowed 'General case' 0 N--CA 1.456 -0.163 0 C-N-CA 127.031 2.132 . . . . 0.0 110.775 -178.033 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 33.4 mm-40 -59.58 -45.39 92.02 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 124.341 1.057 . . . . 0.0 109.631 171.976 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 39.3 ttp180 -56.13 -53.32 58.51 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 125.684 1.594 . . . . 0.0 110.513 176.934 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 9.8 m120 -61.81 -43.45 98.82 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 124.467 1.107 . . . . 0.0 110.742 -179.579 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -60.83 -51.23 70.18 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 124.081 0.952 . . . . 0.0 111.206 -178.541 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 61.1 pttt -66.52 -34.9 78.95 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 118.345 0.52 . . . . 0.0 111.594 -178.101 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 5.3 mt -58.95 -48.08 87.67 Favored 'Isoleucine or valine' 0 C--N 1.342 0.251 0 CA-C-O 118.962 -0.542 . . . . 0.0 109.84 170.407 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 52.0 tptt -60.95 -37.32 81.93 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 118.754 0.706 . . . . 0.0 111.435 179.228 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 19.4 m -59.61 -41.63 90.78 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 118.507 0.594 . . . . 0.0 111.188 174.948 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 70.7 mt -65.61 -60.61 2.44 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.453 0 C-N-CA 123.831 0.852 . . . . 0.0 109.709 177.907 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 3.5 ptm180 -92.09 69.47 5.31 Favored 'General case' 0 C--N 1.341 0.219 0 C-N-CA 123.783 0.833 . . . . 0.0 110.191 174.197 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 38.7 t70 . . . . . 0 CA--C 1.532 0.253 0 N-CA-C 109.91 -0.404 . . . . 0.0 109.91 178.954 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 89.1 mm-40 . . . . . 0 N--CA 1.453 -0.285 0 CA-C-O 118.189 -0.91 . . . . 0.0 112.012 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -36.42 -41.11 0.27 Allowed 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 125.937 1.695 . . . . 0.0 114.204 177.673 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 33.3 tpt85 -69.97 -53.98 15.33 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.352 0.661 . . . . 0.0 111.075 -178.738 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 9.8 mpt_? -61.47 -47.29 86.37 Favored 'General case' 0 CA--C 1.53 0.212 0 C-N-CA 124.446 1.098 . . . . 0.0 109.577 -178.912 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 88.4 t80 -49.42 -51.64 33.96 Favored 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 127.709 2.403 . . . . 0.0 111.33 172.67 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 40.7 t80 -58.41 -47.41 84.01 Favored 'General case' 0 C--N 1.341 0.197 0 CA-C-O 119.019 -0.515 . . . . 0.0 110.803 177.388 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 46.4 mm-40 -58.43 -51.69 68.75 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 118.68 0.673 . . . . 0.0 110.69 178.909 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -56.45 -45.59 80.76 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 124.374 1.07 . . . . 0.0 111.72 -178.994 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 57.7 tp -64.87 -53.47 46.11 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 123.9 0.88 . . . . 0.0 110.384 178.506 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 16.8 m-70 -82.28 57.99 3.86 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 124.643 1.177 . . . . 0.0 109.877 -179.782 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -156.51 78.02 4.15 Favored Pre-proline 0 CA--C 1.534 0.356 0 C-N-CA 124.904 1.282 . . . . 0.0 107.79 178.266 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -82.47 59.08 6.78 Favored 'Trans proline' 0 N--CA 1.456 -0.683 0 C-N-CA 124.323 3.349 . . . . 0.0 110.568 -172.659 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 3.1 p-10 -154.47 -30.9 0.11 Allowed 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 124.806 1.242 . . . . 0.0 111.556 -176.372 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -62.83 153.61 32.55 Favored 'General case' 0 C--N 1.343 0.293 0 CA-C-N 118.742 0.701 . . . . 0.0 109.995 170.782 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 8.9 p30 -65.92 132.48 48.73 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 175.247 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -80.76 65.27 5.84 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 124.276 1.03 . . . . 0.0 108.585 -178.295 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.9 tp10 -152.07 -52.59 0.12 Allowed 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 126.805 2.042 . . . . 0.0 106.636 179.515 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 35.0 mt-30 -63.62 -65.45 0.68 Allowed 'General case' 0 C--N 1.341 0.218 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 171.678 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 18.7 ptt180 -61.59 -33.62 74.2 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-O 119.075 -0.488 . . . . 0.0 111.728 178.266 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 24.5 t-20 -63.88 -49.4 72.87 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 118.482 0.583 . . . . 0.0 111.191 179.031 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.34 -47.55 83.42 Favored 'General case' 0 C--N 1.339 0.15 0 C-N-CA 123.552 0.741 . . . . 0.0 110.864 178.159 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 57.8 mtpt -56.36 -61.19 2.57 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 123.51 0.724 . . . . 0.0 110.176 177.266 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 38.5 mt -49.89 -53.0 11.85 Favored 'Isoleucine or valine' 0 C--N 1.338 0.076 0 C-N-CA 124.946 1.298 . . . . 0.0 110.994 -178.843 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 6.9 ttpm? -53.37 -54.05 42.3 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 124.429 1.092 . . . . 0.0 111.311 178.86 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 51.0 m -56.82 -48.12 78.72 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 122.656 0.382 . . . . 0.0 111.647 179.883 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 67.4 mt -62.27 -50.83 78.39 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.267 0 C-N-CA 124.314 1.046 . . . . 0.0 110.697 -175.278 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 36.2 ptt85 -71.93 -31.85 66.77 Favored 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 112.484 0.55 . . . . 0.0 112.484 -177.301 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 87.6 m-20 . . . . . 0 C--N 1.341 0.226 0 CA-C-N 118.212 0.46 . . . . 0.0 110.855 178.689 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 12.5 mm100 . . . . . 0 CA--C 1.531 0.233 0 CA-C-O 119.901 -0.095 . . . . 0.0 111.157 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 82.2 mt-30 -53.35 -42.49 66.87 Favored 'General case' 0 C--N 1.34 0.182 0 C-N-CA 124.317 1.047 . . . . 0.0 111.337 177.362 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 80.4 mmt-85 -64.26 -42.05 96.65 Favored 'General case' 0 N--CA 1.456 -0.165 0 C-N-CA 123.4 0.68 . . . . 0.0 110.611 -178.16 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.48 -40.25 95.32 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-O 119.546 -0.264 . . . . 0.0 110.54 173.951 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 20.6 m-85 -62.66 -34.07 76.34 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-O 118.716 -0.659 . . . . 0.0 111.496 175.673 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 19.5 m-85 -76.72 55.12 1.03 Allowed 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 119.075 0.852 . . . . 0.0 110.342 172.449 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -178.56 -55.93 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 127.183 2.193 . . . . 0.0 107.676 -179.034 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -80.53 -47.52 14.12 Favored 'General case' 0 C--N 1.34 0.185 0 C-N-CA 123.951 0.9 . . . . 0.0 111.579 -179.366 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.0 tt -78.01 -56.49 4.44 Favored 'General case' 0 C--N 1.338 0.072 0 N-CA-C 107.956 -1.127 . . . . 0.0 107.956 -178.079 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 62.7 m-70 -84.45 54.41 2.99 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 124.422 1.089 . . . . 0.0 109.392 176.95 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -87.45 141.55 32.46 Favored Pre-proline 0 CA--C 1.533 0.318 0 C-N-CA 123.649 0.779 . . . . 0.0 109.785 -179.818 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_exo -43.52 -59.97 0.9 Allowed 'Trans proline' 0 N--CA 1.455 -0.771 0 C-N-CA 124.212 3.275 . . . . 0.0 115.343 173.015 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 9.4 p30 -157.53 25.91 0.29 Allowed 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 115.001 1.482 . . . . 0.0 115.001 -169.969 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 28.5 mt -63.1 133.24 54.14 Favored 'General case' 0 C--N 1.34 0.182 0 CA-C-N 119.647 1.112 . . . . 0.0 109.375 169.974 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 14.2 p30 -65.05 163.82 14.05 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 123.715 0.806 . . . . 0.0 110.527 175.847 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -51.48 -49.11 62.46 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 124.05 0.94 . . . . 0.0 112.314 -175.046 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -58.2 -57.23 13.79 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.312 0.645 . . . . 0.0 110.959 -177.331 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 92.0 mm-40 -66.62 -43.47 84.67 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 123.073 0.549 . . . . 0.0 111.495 -175.217 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 22.3 ttm-85 -56.02 -54.55 43.54 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.761 0.824 . . . . 0.0 109.619 175.889 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -57.17 -40.7 77.81 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 123.877 0.871 . . . . 0.0 111.624 178.282 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -60.42 -45.59 93.07 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 123.061 0.544 . . . . 0.0 111.088 178.429 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 12.3 mmmm -58.75 -47.48 84.51 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 122.591 0.356 . . . . 0.0 110.707 175.56 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 48.2 mm -57.15 -44.49 83.42 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 CA-C-N 117.949 0.34 . . . . 0.0 110.701 177.007 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 1.3 tppm? -61.4 -39.87 92.3 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 123.529 0.732 . . . . 0.0 111.015 178.23 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 20.1 m -60.66 -42.07 96.27 Favored 'General case' 0 CA--C 1.533 0.302 0 O-C-N 121.732 -0.605 . . . . 0.0 111.187 175.301 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 43.2 mt -72.1 -40.37 66.67 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 C-N-CA 124.103 0.961 . . . . 0.0 111.44 -177.052 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 12.2 ptt180 -133.38 91.88 2.92 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 124.424 1.09 . . . . 0.0 108.244 174.477 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 17.5 p-10 . . . . . 0 CA--C 1.536 0.426 0 C-N-CA 125.946 1.699 . . . . 0.0 112.589 178.261 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 44.3 tt0 . . . . . 0 N--CA 1.453 -0.324 0 CA-C-O 119.417 -0.325 . . . . 0.0 110.503 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 18.5 pt20 -59.41 -30.64 68.61 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 123.916 0.887 . . . . 0.0 111.789 -179.561 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 49.5 ttt-85 -66.1 -59.33 3.88 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.832 0.853 . . . . 0.0 110.999 177.278 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 22.8 mtp-105 -56.52 -38.15 71.42 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 124.748 1.219 . . . . 0.0 111.124 177.382 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 23.5 t80 -60.9 -53.46 56.98 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 125.61 1.564 . . . . 0.0 110.824 178.021 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 45.0 t80 -57.11 -49.12 76.88 Favored 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 123.806 0.842 . . . . 0.0 110.11 177.203 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 5.9 tm-20 -53.45 -57.21 11.46 Favored 'General case' 0 C--N 1.341 0.199 0 C-N-CA 123.549 0.74 . . . . 0.0 109.978 178.47 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -53.49 -55.66 23.5 Favored 'General case' 0 N--CA 1.456 -0.174 0 C-N-CA 124.052 0.941 . . . . 0.0 111.232 -178.084 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 63.3 tp -59.1 -54.65 44.6 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 124.462 1.105 . . . . 0.0 111.754 -176.467 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 21.3 m-70 -70.95 -37.78 72.84 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 122.956 0.502 . . . . 0.0 112.11 -173.532 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -67.86 120.63 75.17 Favored Pre-proline 0 CA--C 1.535 0.386 0 CA-C-O 118.957 -0.544 . . . . 0.0 110.737 -176.237 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 75.4 Cg_endo -80.62 -29.74 2.17 Favored 'Trans proline' 0 N--CA 1.455 -0.775 0 C-N-CA 123.39 2.727 . . . . 0.0 111.872 179.313 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 14.6 m120 -58.66 -34.79 71.61 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 125.062 1.345 . . . . 0.0 113.001 -170.803 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 85.6 mt -55.21 135.06 49.92 Favored 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 173.974 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 30.2 p-10 -83.59 48.08 1.37 Allowed 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 123.768 0.827 . . . . 0.0 112.683 -169.894 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 5.6 tm-20 70.81 -64.02 0.39 Allowed 'General case' 0 C--N 1.342 0.28 0 C-N-CA 126.071 1.748 . . . . 0.0 112.201 177.456 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 24.9 pt-20 -54.61 -44.88 73.49 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.89 0.876 . . . . 0.0 112.182 -174.893 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 45.1 mt-30 -64.24 -52.2 59.92 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 123.295 0.638 . . . . 0.0 110.671 178.296 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 26.5 ttp-105 -52.29 -47.85 65.66 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 124.765 1.226 . . . . 0.0 111.354 178.726 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 4.8 m-80 -70.98 -40.29 71.98 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 123.607 0.763 . . . . 0.0 111.379 -178.847 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.89 -45.49 92.33 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.251 0.62 . . . . 0.0 111.065 177.413 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 8.3 mmmm -56.1 -58.5 7.65 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 123.684 0.794 . . . . 0.0 109.44 174.013 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 50.8 mt -55.02 -53.43 34.14 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.275 0 C-N-CA 124.392 1.077 . . . . 0.0 112.209 -175.246 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.65 -43.03 97.96 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 118.557 0.617 . . . . 0.0 111.147 -176.553 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 30.4 t -58.41 -50.95 71.86 Favored 'General case' 0 C--N 1.342 0.263 0 C-N-CA 123.448 0.699 . . . . 0.0 110.211 178.071 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 48.5 mt -55.1 -48.49 76.02 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.189 0 C-N-CA 125.228 1.411 . . . . 0.0 110.894 177.86 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -60.09 -50.78 72.34 Favored 'General case' 0 N--CA 1.455 -0.181 0 CA-C-O 119.187 -0.435 . . . . 0.0 111.208 179.902 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 2.8 p30 . . . . . 0 CA--C 1.536 0.406 0 N-CA-C 113.297 0.851 . . . . 0.0 113.297 -177.979 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 95.4 mt-30 . . . . . 0 N--CA 1.448 -0.525 0 N-CA-C 107.938 -1.134 . . . . 0.0 107.938 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 21.5 tp60 -116.44 -51.88 2.59 Favored 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 124.684 1.193 . . . . 0.0 108.514 174.129 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 13.8 tpt180 -65.31 -55.01 20.7 Favored 'General case' 0 C--N 1.34 0.189 0 C-N-CA 123.25 0.62 . . . . 0.0 109.84 174.032 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 81.5 mtp180 -52.66 -47.23 67.26 Favored 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 124.295 1.038 . . . . 0.0 110.521 178.382 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 8.7 t80 -61.48 -52.45 64.47 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 125.838 1.655 . . . . 0.0 112.095 179.362 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 91.1 t80 -58.26 -43.98 88.17 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 124.341 1.056 . . . . 0.0 110.631 178.54 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -63.78 -43.76 95.38 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.092 0.957 . . . . 0.0 110.849 177.92 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.49 -42.37 98.7 Favored 'General case' 0 C--N 1.341 0.225 0 C-N-CA 123.873 0.869 . . . . 0.0 111.188 176.766 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 58.4 tp -59.46 -51.59 69.23 Favored 'General case' 0 N--CA 1.454 -0.239 0 C-N-CA 123.414 0.685 . . . . 0.0 109.557 176.768 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 22.0 m-70 -93.84 49.52 1.35 Allowed 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 123.881 0.872 . . . . 0.0 110.774 -178.321 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -71.59 165.36 49.81 Favored Pre-proline 0 CA--C 1.539 0.543 0 CA-C-O 118.977 -0.535 . . . . 0.0 110.309 177.35 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -55.49 -65.82 0.1 Allowed 'Trans proline' 0 N--CA 1.457 -0.636 0 C-N-CA 123.148 2.565 . . . . 0.0 112.742 179.944 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 17.3 t-20 -167.73 70.32 0.09 Allowed 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 123.583 0.753 . . . . 0.0 109.762 -179.744 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -79.91 163.8 24.04 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 172.469 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 50.7 p-10 -79.87 17.87 0.89 Allowed 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 114.328 1.233 . . . . 0.0 114.328 -169.967 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 13.5 tp10 71.58 -44.92 0.6 Allowed 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 126.17 1.788 . . . . 0.0 113.187 -176.423 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 14.7 tp10 -57.22 -51.46 69.25 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 119.09 0.859 . . . . 0.0 110.638 178.072 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 45.7 mt-30 -62.15 -46.28 89.66 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 124.041 0.936 . . . . 0.0 111.151 178.883 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 45.9 ttm180 -55.42 -51.29 67.35 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 124.607 1.163 . . . . 0.0 110.402 178.455 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 47.6 t30 -61.5 -51.14 69.88 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 124.52 1.128 . . . . 0.0 110.396 179.54 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -54.51 -45.89 73.39 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 124.091 0.957 . . . . 0.0 111.743 -179.647 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 54.6 mmtt -55.62 -53.33 57.82 Favored 'General case' 0 C--N 1.34 0.169 0 C-N-CA 123.095 0.558 . . . . 0.0 110.214 173.06 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 89.9 mt -60.64 -35.21 62.19 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 C-N-CA 123.155 0.582 . . . . 0.0 111.866 -176.263 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 64.1 mttm -63.04 -48.41 78.81 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 119.162 0.892 . . . . 0.0 110.07 170.556 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 15.0 m -74.59 3.28 8.01 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 124.432 1.093 . . . . 0.0 113.459 -178.606 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 57.5 mt -107.85 -61.5 2.48 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.237 0 N-CA-C 106.867 -1.531 . . . . 0.0 106.867 171.543 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 19.7 tpp180 -81.4 68.96 7.93 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 125.187 1.395 . . . . 0.0 108.843 174.948 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 . . . . . 0 CA--C 1.531 0.236 0 N-CA-C 108.501 -0.925 . . . . 0.0 108.501 174.814 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 36.0 tt0 . . . . . 0 N--CA 1.456 -0.152 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 67.6 mt-30 -46.29 -33.8 4.02 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 125.861 1.664 . . . . 0.0 113.124 -169.957 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 44.8 mtt180 -56.34 -72.86 0.07 Allowed 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.446 1.098 . . . . 0.0 111.416 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -64.39 -38.38 90.82 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 124.284 1.033 . . . . 0.0 110.923 -178.743 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 49.2 t80 -59.43 -53.31 59.61 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 126.23 1.812 . . . . 0.0 110.966 -177.594 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 47.7 t80 -62.49 -45.04 94.82 Favored 'General case' 0 C--N 1.341 0.227 0 C-N-CA 123.562 0.745 . . . . 0.0 110.284 175.794 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 15.8 tp10 -55.74 -49.39 73.21 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 122.549 0.339 . . . . 0.0 110.866 -179.097 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.24 -51.46 68.85 Favored 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 123.8 0.84 . . . . 0.0 111.165 179.083 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 57.7 tp -60.65 -57.75 11.38 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 123.915 0.886 . . . . 0.0 111.2 -176.905 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 29.0 m-70 -83.41 61.81 6.39 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 124.738 1.215 . . . . 0.0 109.765 -178.659 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -158.6 120.27 1.93 Allowed Pre-proline 0 CA--C 1.533 0.326 0 C-N-CA 123.911 0.884 . . . . 0.0 109.061 177.69 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -77.9 -27.65 5.68 Favored 'Trans proline' 0 N--CA 1.455 -0.736 0 C-N-CA 123.316 2.677 . . . . 0.0 112.01 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -54.71 -53.68 51.8 Favored 'General case' 0 C--N 1.344 0.341 0 C-N-CA 123.711 0.804 . . . . 0.0 110.218 -179.335 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 81.1 mt -71.03 121.53 18.38 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 107.146 -1.428 . . . . 0.0 107.146 169.625 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 25.3 p30 -72.57 175.54 6.24 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-O 120.749 0.309 . . . . 0.0 110.742 -177.747 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -59.2 -51.39 70.18 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 123.186 0.594 . . . . 0.0 111.972 -171.729 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -62.77 -38.53 90.99 Favored 'General case' 0 CA--C 1.534 0.34 0 N-CA-C 111.867 0.321 . . . . 0.0 111.867 -179.551 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 85.5 mt-30 -62.28 -56.46 18.29 Favored 'General case' 0 C--N 1.34 0.163 0 C-N-CA 123.496 0.718 . . . . 0.0 110.823 178.523 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 31.6 ptt180 -66.29 -32.11 73.33 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 112.098 0.407 . . . . 0.0 112.098 -177.578 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 72.6 m-20 -64.93 -40.01 94.38 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 118.226 0.466 . . . . 0.0 110.864 172.224 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -63.38 -44.4 94.83 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 118.057 0.39 . . . . 0.0 110.669 175.953 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 11.9 mmmm -55.41 -51.49 66.69 Favored 'General case' 0 C--N 1.341 0.223 0 C-N-CA 123.237 0.615 . . . . 0.0 110.439 174.642 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 33.9 mt -51.74 -53.28 17.7 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.189 0 C-N-CA 123.404 0.682 . . . . 0.0 110.327 175.97 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 82.2 tttt -65.01 -25.84 68.03 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.039 0.535 . . . . 0.0 112.316 -177.359 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 49.5 m -74.34 -46.96 37.37 Favored 'General case' 0 CA--C 1.529 0.16 0 CA-C-N 118.691 0.678 . . . . 0.0 110.716 175.727 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 40.8 mt -63.72 -62.13 1.35 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.261 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 179.197 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 52.1 ttp85 -78.88 75.89 5.38 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 125.335 1.454 . . . . 0.0 107.72 170.09 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 . . . . . 0 CA--C 1.534 0.333 0 C-N-CA 127.336 2.254 . . . . 0.0 112.529 -178.129 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.4 mp0 . . . . . 0 CA--C 1.533 0.312 0 CA-C-O 119.845 -0.121 . . . . 0.0 111.314 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 22.6 tt0 -54.33 -43.25 71.05 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 125.188 1.395 . . . . 0.0 111.635 176.473 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.48 -58.45 7.97 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 124.157 0.983 . . . . 0.0 109.488 177.226 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -61.39 -38.45 87.07 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-O 118.932 -0.556 . . . . 0.0 111.917 -178.933 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 25.1 m-85 -61.49 -43.79 98.24 Favored 'General case' 0 C--N 1.342 0.241 0 CA-C-N 118.999 0.818 . . . . 0.0 110.917 177.733 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 53.5 t80 -60.16 -46.74 88.64 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 118.082 0.401 . . . . 0.0 110.094 175.112 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 15.5 tp10 -56.38 -45.15 80.67 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 117.95 0.341 . . . . 0.0 110.876 177.934 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.15 -53.73 48.79 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 124.341 1.056 . . . . 0.0 111.336 -178.677 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 58.7 mt -61.95 -54.27 44.14 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 123.5 0.72 . . . . 0.0 110.575 -178.686 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 29.0 m-70 -85.1 66.21 9.63 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.265 1.026 . . . . 0.0 109.276 -177.82 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -127.46 140.34 37.72 Favored Pre-proline 0 CA--C 1.536 0.409 0 C-N-CA 125.743 1.617 . . . . 0.0 108.531 -178.544 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -76.89 -38.73 0.78 Allowed 'Trans proline' 0 N--CA 1.457 -0.636 0 C-N-CA 123.085 2.523 . . . . 0.0 112.841 -178.872 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 35.3 m120 -81.16 74.04 8.18 Favored 'General case' 0 C--N 1.34 0.185 0 C-N-CA 124.262 1.025 . . . . 0.0 110.498 -173.547 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 33.2 mt -98.86 140.14 33.48 Favored 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 112.937 0.717 . . . . 0.0 112.937 -174.762 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 52.1 p-10 -153.79 12.53 0.45 Allowed 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 126.561 1.944 . . . . 0.0 110.197 169.683 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 18.7 tp10 67.02 -47.5 0.47 Allowed 'General case' 0 C--N 1.346 0.449 0 C-N-CA 128.105 2.562 . . . . 0.0 113.177 -171.176 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 5.2 tm-20 -49.05 -45.21 42.52 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 124.789 1.235 . . . . 0.0 111.882 177.637 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 49.4 mm-40 -65.09 -41.54 94.88 Favored 'General case' 0 C--N 1.34 0.192 0 N-CA-C 109.902 -0.407 . . . . 0.0 109.902 -179.438 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 4.4 mmp_? -59.68 -61.85 2.31 Favored 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 177.492 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 17.4 t-20 -45.96 -50.18 15.04 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 126.128 1.771 . . . . 0.0 111.947 -177.878 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -55.7 -44.99 77.91 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 124.182 0.993 . . . . 0.0 111.595 176.259 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 26.1 mtpp -69.4 -42.08 75.56 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-O 118.432 -0.794 . . . . 0.0 111.777 179.635 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 10.3 mm -54.67 -53.97 27.13 Favored 'Isoleucine or valine' 0 C--N 1.345 0.377 0 CA-C-N 119.452 1.024 . . . . 0.0 110.144 -176.385 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 9.8 ptpp? -59.06 -41.41 87.85 Favored 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 111.889 0.329 . . . . 0.0 111.889 -178.579 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 37.6 m -60.49 -44.33 96.06 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 123.011 0.524 . . . . 0.0 111.117 177.559 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 63.1 mt -63.89 -42.55 96.18 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 C-N-CA 123.892 0.877 . . . . 0.0 110.24 179.109 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 34.3 mmt180 -58.89 -39.58 81.87 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 122.98 0.512 . . . . 0.0 110.65 175.608 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 65.9 m-20 . . . . . 0 CA--C 1.532 0.278 0 C-N-CA 122.738 0.415 . . . . 0.0 111.286 178.548 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.3 tp-100 . . . . . 0 CA--C 1.531 0.238 0 N-CA-C 110.905 -0.035 . . . . 0.0 110.905 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 29.1 mm100 -60.86 -36.09 78.28 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-O 118.995 -0.526 . . . . 0.0 111.463 175.519 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.81 -39.46 83.98 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 118.473 0.579 . . . . 0.0 111.251 176.115 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 74.5 mtt85 -61.18 -46.71 89.38 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 118.42 0.554 . . . . 0.0 110.308 175.449 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 21.7 m-85 -61.14 -46.76 89.22 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 122.659 0.384 . . . . 0.0 111.261 175.855 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 52.8 t80 -54.81 -49.92 69.81 Favored 'General case' 0 C--O 1.225 -0.208 0 C-N-CA 124.034 0.933 . . . . 0.0 110.32 179.741 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -57.59 -52.81 63.9 Favored 'General case' 0 CA--C 1.531 0.229 0 N-CA-C 109.712 -0.477 . . . . 0.0 109.712 174.704 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -70.27 9.67 0.56 Allowed 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.885 1.274 . . . . 0.0 114.12 -179.987 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 64.6 tp -123.25 -37.48 2.69 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.457 1.103 . . . . 0.0 110.971 172.672 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 17.2 m-70 -90.95 -28.68 17.9 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.871 1.268 . . . . 0.0 113.464 -174.993 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -51.07 136.67 28.22 Favored Pre-proline 0 CA--C 1.543 0.687 0 C-N-CA 124.264 1.026 . . . . 0.0 112.297 -174.661 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_exo -45.53 -46.52 14.52 Favored 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 124.541 3.494 . . . . 0.0 115.777 -179.807 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 3.6 t30 -67.38 120.53 14.02 Favored 'General case' 0 C--N 1.34 0.172 0 N-CA-C 109.678 -0.49 . . . . 0.0 109.678 -177.699 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -156.04 130.28 8.76 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 122.86 0.464 . . . . 0.0 111.083 -173.911 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 1.8 p-10 -157.58 33.67 0.27 Allowed 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.11 0.964 . . . . 0.0 111.142 170.043 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.8 tm-20 72.33 -57.39 0.62 Allowed 'General case' 0 C--N 1.346 0.427 0 C-N-CA 127.054 2.142 . . . . 0.0 113.499 174.668 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 6.6 tm-20 -54.64 -49.53 70.34 Favored 'General case' 0 CA--C 1.529 0.158 0 C-N-CA 124.649 1.18 . . . . 0.0 110.416 -177.081 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 13.4 mm100 -56.27 -49.88 72.94 Favored 'General case' 0 C--N 1.341 0.233 0 C-N-CA 123.259 0.623 . . . . 0.0 109.764 -178.231 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 5.3 mpt_? -51.44 -73.82 0.04 OUTLIER 'General case' 0 CA--C 1.515 -0.385 0 C-N-CA 125.12 1.368 . . . . 0.0 110.745 178.023 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 18.3 m-80 -54.24 -38.15 65.42 Favored 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 111.914 0.339 . . . . 0.0 111.914 -170.787 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -61.16 -58.14 9.58 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 123.071 0.549 . . . . 0.0 111.812 175.933 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 14.8 ptpt -67.83 -44.23 77.72 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 118.008 0.367 . . . . 0.0 111.132 -174.679 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 6.3 mm -48.05 -52.04 8.01 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.16 0 C-N-CA 125.686 1.595 . . . . 0.0 109.962 174.148 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 23.0 ttmm -60.91 -48.95 79.44 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 123.804 0.842 . . . . 0.0 111.248 -178.763 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 83.7 p -62.79 -40.88 98.69 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 122.553 0.341 . . . . 0.0 111.849 -178.176 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 61.3 mt -63.3 -44.13 98.98 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.321 0 C-N-CA 124.075 0.95 . . . . 0.0 109.057 175.021 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 33.2 ttm180 -80.88 55.01 2.31 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 125.176 1.391 . . . . 0.0 110.478 179.447 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 23.3 t70 . . . . . 0 CA--C 1.529 0.135 0 C-N-CA 125.58 1.552 . . . . 0.0 108.666 175.341 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 72.7 mt-30 . . . . . 0 CA--C 1.528 0.125 0 N-CA-C 111.97 0.359 . . . . 0.0 111.97 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -52.72 -48.97 66.3 Favored 'General case' 0 N--CA 1.456 -0.17 0 C-N-CA 123.058 0.543 . . . . 0.0 109.666 171.582 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 16.2 mmm-85 -67.91 -34.28 76.32 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-O 118.47 -0.776 . . . . 0.0 112.88 175.907 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 28.4 mmt85 -56.58 -51.7 67.64 Favored 'General case' 0 C--N 1.341 0.236 0 CA-C-N 119.175 0.898 . . . . 0.0 109.705 175.166 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 11.0 m-85 -56.47 -52.19 65.62 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 123.814 0.845 . . . . 0.0 110.918 173.419 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 31.6 t80 -78.97 60.91 3.03 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.485 1.114 . . . . 0.0 109.883 -179.529 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 178.94 -55.03 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 127.339 2.256 . . . . 0.0 107.362 -174.724 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.37 -44.99 96.23 Favored 'General case' 0 C--N 1.34 0.181 0 C-N-CA 124.899 1.279 . . . . 0.0 110.565 175.232 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 89.4 mt -58.33 -47.43 83.76 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 123.118 0.567 . . . . 0.0 109.844 172.343 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 22.5 m-70 -86.37 54.96 3.34 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 124.412 1.085 . . . . 0.0 110.331 -176.535 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 10.6 t0 -124.99 85.18 58.14 Favored Pre-proline 0 CA--C 1.535 0.373 0 C-N-CA 124.425 1.09 . . . . 0.0 109.382 -175.93 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -82.14 59.4 7.02 Favored 'Trans proline' 0 N--CA 1.456 -0.71 0 C-N-CA 123.856 3.037 . . . . 0.0 109.887 179.626 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -155.72 -58.62 0.1 Allowed 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 124.586 1.154 . . . . 0.0 108.981 179.286 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 91.2 mt -70.78 144.16 50.96 Favored 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 174.699 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 29.8 p-10 -79.51 174.66 11.35 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-O 121.195 0.521 . . . . 0.0 110.867 179.943 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 35.8 tp10 -60.88 -36.75 80.02 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 123.772 0.829 . . . . 0.0 111.592 -176.995 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 51.9 mt-10 -59.76 -57.51 12.59 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 123.322 0.649 . . . . 0.0 110.735 179.728 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 37.3 mt-30 -59.59 -47.76 84.31 Favored 'General case' 0 CA--C 1.529 0.148 0 C-N-CA 124.042 0.937 . . . . 0.0 110.787 -178.995 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 12.1 ttp-105 -52.83 -55.13 25.28 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 124.716 1.206 . . . . 0.0 111.046 176.972 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 6.5 m120 -59.95 -44.91 94.11 Favored 'General case' 0 CA--C 1.529 0.156 0 C-N-CA 122.693 0.397 . . . . 0.0 110.858 179.324 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.19 -51.08 69.34 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 123.991 0.916 . . . . 0.0 111.744 -177.768 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 19.7 ptpt -65.09 -41.41 95.02 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 118.113 0.415 . . . . 0.0 111.302 179.499 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 5.7 mt -60.39 -52.27 63.33 Favored 'Isoleucine or valine' 0 C--N 1.34 0.171 0 CA-C-O 118.755 -0.64 . . . . 0.0 111.176 -179.452 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 15.0 ptmm? -62.09 -37.67 85.95 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 118.856 0.753 . . . . 0.0 111.591 -178.783 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 55.7 m -61.24 -50.51 72.76 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 122.9 0.48 . . . . 0.0 111.014 177.531 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 89.3 mt -60.88 -51.71 70.02 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 C-N-CA 123.89 0.876 . . . . 0.0 110.195 179.194 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 37.7 ttm180 -60.24 -36.29 77.42 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 124.846 1.258 . . . . 0.0 111.624 -177.172 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 35.9 t70 . . . . . 0 N--CA 1.453 -0.284 0 C-N-CA 123.729 0.812 . . . . 0.0 109.293 173.391 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 63.6 tt0 . . . . . 0 N--CA 1.453 -0.314 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -57.75 -38.06 74.73 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.868 1.267 . . . . 0.0 111.617 174.487 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 40.6 tpt85 -67.65 -51.81 45.55 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 123.715 0.806 . . . . 0.0 110.631 -178.768 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 78.2 ttt-85 -57.74 -51.71 68.44 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 125.586 1.554 . . . . 0.0 110.645 176.793 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 13.1 t80 -47.14 -59.74 2.94 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 126.243 1.817 . . . . 0.0 111.513 173.508 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 50.9 t80 -56.09 -49.18 74.56 Favored 'General case' 0 N--CA 1.456 -0.141 0 C-N-CA 124.128 0.971 . . . . 0.0 110.843 -179.42 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -56.77 -54.52 45.31 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 123.442 0.697 . . . . 0.0 110.748 -177.822 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.21 -44.52 97.15 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 123.658 0.783 . . . . 0.0 111.944 -178.349 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 59.8 tp -61.36 -53.2 59.75 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 124.23 1.012 . . . . 0.0 110.993 -179.621 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 19.4 m-70 -76.62 -50.98 12.46 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 123.593 0.757 . . . . 0.0 111.951 -173.694 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 9.5 t0 -67.23 124.29 88.6 Favored Pre-proline 0 CA--C 1.535 0.389 0 CA-C-O 118.87 -0.586 . . . . 0.0 109.668 -174.84 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_endo -76.15 -10.03 19.3 Favored 'Trans proline' 0 N--CA 1.456 -0.707 0 C-N-CA 123.412 2.741 . . . . 0.0 114.355 -171.937 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -62.56 -31.84 72.7 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 114.382 1.253 . . . . 0.0 114.382 -169.981 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 10.6 mp -63.67 146.63 53.44 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 118.555 0.616 . . . . 0.0 110.073 177.153 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 44.0 p-10 -84.62 29.35 0.61 Allowed 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 114.451 1.278 . . . . 0.0 114.451 -169.71 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 76.34 -58.37 0.53 Allowed 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 124.852 1.261 . . . . 0.0 111.384 -174.878 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 5.6 mp0 -56.88 -49.95 73.98 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 123.385 0.674 . . . . 0.0 110.663 -178.732 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 59.7 mt-30 -51.61 -60.0 3.65 Favored 'General case' 0 C--N 1.34 0.17 0 C-N-CA 124.44 1.096 . . . . 0.0 111.084 178.423 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 10.7 ptp85 -63.42 -44.97 93.08 Favored 'General case' 0 C--N 1.342 0.251 0 CA-C-O 119.253 -0.403 . . . . 0.0 110.75 -175.883 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -55.23 -51.86 65.23 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 123.748 0.819 . . . . 0.0 111.094 -178.132 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -53.78 -53.52 51.15 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 123.641 0.777 . . . . 0.0 111.485 -178.475 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 19.9 ptpt -69.8 -36.94 76.08 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-O 118.648 -0.691 . . . . 0.0 112.007 -178.704 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 44.4 mt -59.44 -45.3 93.73 Favored 'Isoleucine or valine' 0 C--N 1.34 0.189 0 CA-C-N 119.1 0.864 . . . . 0.0 110.162 178.855 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 44.2 mmtm -59.29 -43.27 92.57 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 122.49 0.316 . . . . 0.0 110.496 175.639 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 16.0 m -63.75 -42.21 97.89 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.281 0.632 . . . . 0.0 111.714 179.104 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 30.5 mt -61.56 -49.41 84.51 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.195 0 C-N-CA 125.128 1.371 . . . . 0.0 109.228 176.884 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -82.87 51.47 1.92 Allowed 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 124.714 1.206 . . . . 0.0 110.57 -179.679 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 3.9 p30 . . . . . 0 CA--C 1.531 0.233 0 C-N-CA 123.299 0.64 . . . . 0.0 109.792 171.431 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 21.4 tt0 . . . . . 0 CA--C 1.53 0.199 0 N-CA-C 110.221 -0.289 . . . . 0.0 110.221 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 20.1 tt0 -53.81 -37.02 63.11 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 125.286 1.434 . . . . 0.0 111.508 176.47 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 13.4 mmp_? -70.78 -51.29 27.92 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 118.883 0.765 . . . . 0.0 111.64 178.832 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.42 -50.38 67.73 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 118.897 0.772 . . . . 0.0 109.996 176.973 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 78.1 t80 -50.32 -55.88 13.63 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 126.941 2.096 . . . . 0.0 112.081 174.172 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 49.4 t80 -58.82 -48.66 80.52 Favored 'General case' 0 C--N 1.339 0.14 0 C-N-CA 124.6 1.16 . . . . 0.0 110.927 -178.298 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -54.91 -54.67 39.64 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 123.494 0.717 . . . . 0.0 109.806 178.985 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -56.68 -49.08 76.16 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 122.616 0.366 . . . . 0.0 111.904 -179.671 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 54.4 tp -58.43 -53.67 55.68 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 124.084 0.954 . . . . 0.0 111.333 -178.837 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 19.4 m-70 -77.39 -45.77 24.86 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.783 0.833 . . . . 0.0 112.648 -171.489 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 80.0 m-20 -62.9 130.7 94.19 Favored Pre-proline 0 CA--C 1.537 0.456 0 CA-C-N 118.215 0.462 . . . . 0.0 110.647 -171.254 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -70.77 -29.28 19.3 Favored 'Trans proline' 0 N--CA 1.457 -0.634 0 C-N-CA 123.973 3.115 . . . . 0.0 113.562 -169.755 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 9.8 p-10 -58.76 -27.99 65.48 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 118.493 0.588 . . . . 0.0 111.796 -179.863 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -84.08 72.13 10.5 Favored 'General case' 0 C--N 1.342 0.273 0 N-CA-C 106.112 -1.81 . . . . 0.0 106.112 169.442 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 -77.29 58.09 1.58 Allowed 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 125.612 1.565 . . . . 0.0 112.687 -169.997 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 22.6 tt0 70.76 157.59 0.17 Allowed 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 125.239 1.416 . . . . 0.0 110.63 -176.919 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.3 tp10 73.8 -56.13 0.65 Allowed 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 127.027 2.131 . . . . 0.0 110.811 -175.392 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 50.9 mt-30 -54.86 -61.59 2.21 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 125.31 1.444 . . . . 0.0 110.01 175.632 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 19.4 ptt180 -63.23 -38.88 92.92 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 123.599 0.76 . . . . 0.0 111.76 178.861 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 14.4 m120 -61.0 -45.02 96.5 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 118.387 0.539 . . . . 0.0 111.099 179.924 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -60.12 -47.54 85.48 Favored 'General case' 0 CA--C 1.529 0.165 0 C-N-CA 123.564 0.745 . . . . 0.0 110.439 176.639 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 30.6 tttt -55.32 -51.17 67.59 Favored 'General case' 0 N--CA 1.448 -0.541 0 C-N-CA 123.441 0.697 . . . . 0.0 111.396 175.748 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 58.2 mt -58.39 -44.73 89.2 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.205 0 C-N-CA 124.269 1.028 . . . . 0.0 110.293 -179.361 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 27.2 ttpp -58.77 -46.95 86.32 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 123.488 0.715 . . . . 0.0 111.251 177.071 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 88.9 p -68.22 -37.87 81.3 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 118.438 0.563 . . . . 0.0 111.94 -179.705 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 68.8 mt -64.82 -60.7 2.34 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.188 0 C-N-CA 123.907 0.883 . . . . 0.0 110.149 179.238 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 17.7 ptp180 -133.66 70.38 1.46 Allowed 'General case' 0 N--CA 1.456 -0.133 0 C-N-CA 123.99 0.916 . . . . 0.0 109.734 -173.215 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 25.3 t70 . . . . . 0 CA--C 1.531 0.221 0 C-N-CA 124.363 1.065 . . . . 0.0 111.556 177.968 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.54 0.582 0 CA-C-O 121.941 0.877 . . . . 0.0 109.969 . . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? -165.17 -52.78 0.03 OUTLIER 'General case' 0 CA--C 1.523 -0.075 0 C-N-CA 126.777 2.031 . . . . 0.0 106.465 -178.947 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 6.1 tmm_? -50.78 -48.56 59.35 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 125.435 1.494 . . . . 0.0 109.874 171.961 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 19.2 ptp180 -63.87 -45.24 90.34 Favored 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 112.582 0.586 . . . . 0.0 112.582 -179.01 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 60.8 m-85 -64.11 -47.42 80.07 Favored 'General case' 0 C--N 1.339 0.139 0 C-N-CA 122.66 0.384 . . . . 0.0 110.386 -179.66 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 64.1 t80 -56.64 -46.82 80.77 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 123.902 0.881 . . . . 0.0 110.495 175.236 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 12.9 tp10 -58.77 -58.47 8.46 Favored 'General case' 0 N--CA 1.455 -0.225 0 C-N-CA 122.949 0.5 . . . . 0.0 110.027 -179.228 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -52.93 -47.24 68.17 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 124.648 1.179 . . . . 0.0 111.588 -179.982 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 63.7 tp -60.14 -49.93 75.69 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.095 0.958 . . . . 0.0 110.612 178.221 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 17.1 m-70 -85.46 54.76 3.23 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.135 0.974 . . . . 0.0 110.453 -178.996 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 73.7 m-20 -135.29 83.49 38.16 Favored Pre-proline 0 CA--C 1.532 0.288 0 C-N-CA 124.698 1.199 . . . . 0.0 108.68 171.482 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_exo -51.99 -42.93 55.72 Favored 'Trans proline' 0 N--CA 1.459 -0.517 0 C-N-CA 124.118 3.212 . . . . 0.0 113.167 175.721 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 50.3 t30 -55.29 -46.66 76.2 Favored 'General case' 0 C--N 1.341 0.21 0 C-N-CA 124.6 1.16 . . . . 0.0 111.651 -178.611 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -73.04 108.81 6.14 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 106.734 -1.58 . . . . 0.0 106.734 173.346 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 1.9 p30 -64.79 170.14 4.47 Favored 'General case' 0 CA--C 1.531 0.218 0 N-CA-C 111.538 0.199 . . . . 0.0 111.538 -172.389 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -47.05 -41.73 17.27 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 124.659 1.184 . . . . 0.0 112.683 -177.093 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 14.3 tp10 -60.83 -58.47 8.31 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 118.354 0.525 . . . . 0.0 110.976 179.503 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 71.9 mt-30 -58.15 -50.55 73.11 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 124.211 1.004 . . . . 0.0 110.806 -178.507 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 17.9 ttp180 -56.83 -55.17 37.83 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 125.594 1.558 . . . . 0.0 110.999 -179.813 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 -60.04 -42.2 93.92 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 122.806 0.443 . . . . 0.0 111.109 179.474 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.96 -43.34 91.27 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 123.196 0.599 . . . . 0.0 111.167 177.509 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 25.8 mmtp -58.5 -58.46 8.42 Favored 'General case' 0 C--N 1.341 0.229 0 C-N-CA 122.875 0.47 . . . . 0.0 110.181 174.883 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 30.3 mm -48.87 -51.77 11.32 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 C-N-CA 123.623 0.769 . . . . 0.0 110.724 -179.522 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 66.0 tttp -61.41 -54.85 38.21 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 124.303 1.041 . . . . 0.0 111.221 -178.168 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 85.6 p -59.3 -38.67 80.81 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 123.261 0.625 . . . . 0.0 112.141 -175.593 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 71.6 mt -61.04 -55.07 27.19 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 C-N-CA 123.578 0.751 . . . . 0.0 110.442 -179.502 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 19.5 ptp180 -72.05 -49.51 36.08 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 118.155 0.434 . . . . 0.0 111.447 -178.225 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 31.9 t70 . . . . . 0 CA--C 1.53 0.193 0 C-N-CA 124.697 1.199 . . . . 0.0 108.631 177.979 . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 20.3 tt0 . . . . . 0 CA--C 1.534 0.333 0 N-CA-C 110.775 -0.083 . . . . 0.0 110.775 . . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 18.4 tt0 -54.4 -29.76 50.03 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 126.204 1.801 . . . . 0.0 112.021 175.042 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 21.0 mmt85 -70.71 -57.54 4.57 Favored 'General case' 0 C--N 1.341 0.2 0 CA-C-N 118.972 0.806 . . . . 0.0 109.397 177.668 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 79.7 mtt85 -50.58 -47.67 57.86 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 124.215 1.006 . . . . 0.0 110.632 177.76 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 31.2 t80 -48.68 -51.35 28.97 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 126.423 1.889 . . . . 0.0 111.287 173.891 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 18.2 m-30 -68.0 -35.67 78.72 Favored 'General case' 0 C--O 1.225 -0.218 0 C-N-CA 123.233 0.613 . . . . 0.0 111.649 179.142 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -60.55 -25.23 66.0 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 119.803 1.183 . . . . 0.0 111.64 175.813 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -84.45 -49.79 8.34 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 123.234 0.614 . . . . 0.0 111.497 171.727 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 34.4 tp -82.42 -57.47 3.34 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.065 0.946 . . . . 0.0 111.413 -170.295 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 25.0 m170 -77.68 69.63 3.95 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 125.404 1.482 . . . . 0.0 108.778 177.727 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -158.45 158.38 29.56 Favored Pre-proline 0 CA--C 1.534 0.333 0 C-N-CA 124.666 1.186 . . . . 0.0 107.866 -172.157 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -67.5 42.2 0.21 Allowed 'Trans proline' 0 CA--C 1.544 1.01 0 C-N-CA 123.737 2.958 . . . . 0.0 114.219 169.767 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 14.9 t-20 61.16 92.89 0.05 OUTLIER 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 126.955 2.102 . . . . 0.0 112.578 177.777 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 78.2 mt -64.51 162.32 15.59 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 169.729 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 10.0 p30 -54.63 144.41 21.87 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 123.088 0.555 . . . . 0.0 110.646 178.182 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 15.3 mp0 -52.45 -42.18 63.94 Favored 'General case' 0 C--O 1.226 -0.143 0 C-N-CA 124.411 1.084 . . . . 0.0 112.013 -173.932 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.4 tm-20 -56.43 -61.73 2.21 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 122.915 0.486 . . . . 0.0 110.551 -177.757 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 79.5 mm-40 -61.2 -51.95 66.86 Favored 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 123.135 0.574 . . . . 0.0 110.916 179.197 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 32.2 ttp-105 -57.19 -61.98 2.08 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 123.693 0.797 . . . . 0.0 110.706 -174.142 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 14.4 t-20 -59.39 -39.7 84.19 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 123.974 0.91 . . . . 0.0 111.174 -175.548 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -57.15 -51.27 70.0 Favored 'General case' 0 C--N 1.342 0.257 0 C-N-CA 122.695 0.398 . . . . 0.0 110.83 176.447 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 59.8 mtpt -59.3 -54.84 42.16 Favored 'General case' 0 C--N 1.341 0.238 0 C-N-CA 123.081 0.552 . . . . 0.0 110.59 177.381 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 14.6 mm -51.14 -49.73 28.0 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.276 0 C-N-CA 124.207 1.003 . . . . 0.0 110.682 -178.384 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 27.7 tptp -73.07 -42.21 63.3 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 123.216 0.606 . . . . 0.0 111.973 -175.445 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 99.1 p -61.97 -34.39 76.05 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 118.647 0.658 . . . . 0.0 111.015 178.873 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 90.7 mt -73.11 -49.47 38.28 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.255 0 C-N-CA 124.518 1.127 . . . . 0.0 109.596 175.682 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 81.5 mtp180 -89.77 61.78 5.52 Favored 'General case' 0 CA--C 1.529 0.165 0 C-N-CA 124.228 1.011 . . . . 0.0 108.822 176.542 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 30.2 t0 . . . . . 0 N--CA 1.453 -0.288 0 C-N-CA 123.817 0.847 . . . . 0.0 109.387 -176.318 . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 20.2 mt-30 . . . . . 0 N--CA 1.449 -0.504 0 N-CA-C 107.394 -1.336 . . . . 0.0 107.394 . . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 17.8 tp60 -149.51 -51.21 0.15 Allowed 'General case' 0 CA--C 1.532 0.25 0 CA-C-O 118.923 -0.561 . . . . 0.0 111.834 -176.663 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -70.11 -79.59 0.06 Allowed 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 118.851 0.751 . . . . 0.0 110.557 -172.874 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -55.88 -26.2 46.01 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 124.522 1.129 . . . . 0.0 112.243 173.688 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 62.2 t80 -67.75 -49.43 62.57 Favored 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 125.202 1.401 . . . . 0.0 110.973 178.94 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 70.4 t80 -58.08 -41.15 82.82 Favored 'General case' 0 C--N 1.34 0.19 0 CA-C-O 119.194 -0.431 . . . . 0.0 110.128 174.31 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 15.3 tp10 -59.23 -57.97 10.67 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 118.356 0.525 . . . . 0.0 110.042 176.68 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -52.68 -46.46 67.27 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 124.672 1.189 . . . . 0.0 112.359 -178.245 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 73.0 mt -62.75 -62.14 1.93 Allowed 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.211 0.604 . . . . 0.0 109.775 175.776 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 19.6 m-70 -84.97 48.82 1.62 Allowed 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.53 1.132 . . . . 0.0 110.711 -177.095 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -77.73 162.13 69.16 Favored Pre-proline 0 CA--C 1.538 0.488 0 N-CA-C 108.394 -0.965 . . . . 0.0 108.394 173.711 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -79.13 65.2 8.88 Favored 'Trans proline' 0 N--CA 1.454 -0.842 0 C-N-CA 124.243 3.295 . . . . 0.0 109.861 179.704 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 31.0 m120 59.25 67.78 0.87 Allowed 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 126.792 2.037 . . . . 0.0 112.768 169.97 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 82.0 mt -67.92 166.42 15.71 Favored 'General case' 0 CA--C 1.532 0.283 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 169.72 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 48.7 p-10 -75.9 26.35 0.11 Allowed 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.851 1.26 . . . . 0.0 113.91 -174.54 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 73.01 -55.61 0.68 Allowed 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 126.03 1.732 . . . . 0.0 111.689 -174.954 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -53.83 -54.53 37.12 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 125.094 1.358 . . . . 0.0 111.303 -177.567 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 42.7 mt-30 -61.22 -45.31 95.09 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 123.686 0.794 . . . . 0.0 111.128 -178.813 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 37.6 ttm105 -56.98 -55.85 29.32 Favored 'General case' 0 C--N 1.34 0.196 0 C-N-CA 122.845 0.458 . . . . 0.0 110.118 177.394 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 47.9 m-20 -54.35 -45.19 72.68 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 123.994 0.918 . . . . 0.0 111.052 -179.865 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.43 -43.97 88.94 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 123.351 0.66 . . . . 0.0 111.302 177.165 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 61.2 mtpt -62.06 -45.15 94.79 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-O 119.079 -0.486 . . . . 0.0 110.91 176.986 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 45.2 mm -57.98 -47.34 86.85 Favored 'Isoleucine or valine' 0 C--N 1.342 0.259 0 CA-C-N 118.851 0.751 . . . . 0.0 110.328 176.183 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 63.0 mttp -58.75 -39.16 80.13 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 123.035 0.534 . . . . 0.0 111.563 177.52 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 40.4 m -63.72 -46.42 85.5 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 122.853 0.461 . . . . 0.0 110.946 177.189 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 74.1 mt -63.14 -42.16 95.52 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 C-N-CA 123.567 0.747 . . . . 0.0 110.2 178.892 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 1.5 mmp_? -59.33 -52.24 66.49 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 124.043 0.937 . . . . 0.0 110.035 176.611 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 37.2 t70 . . . . . 0 CA--C 1.531 0.246 0 C-N-CA 124.361 1.064 . . . . 0.0 109.595 179.535 . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 18.7 tp60 . . . . . 0 N--CA 1.455 -0.186 0 CA-C-O 119.007 -0.52 . . . . 0.0 110.701 . . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 22.6 pt20 -50.48 -35.93 31.35 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.394 1.077 . . . . 0.0 112.653 178.166 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 19.5 tpp85 -71.74 -49.42 39.31 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 124.16 0.984 . . . . 0.0 111.312 -179.522 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 38.6 mtp180 -58.94 -47.49 84.87 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 124.277 1.031 . . . . 0.0 110.078 177.125 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 36.3 t80 -53.25 -55.81 21.55 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 126.694 1.998 . . . . 0.0 110.812 174.577 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 44.7 t80 -54.15 -49.29 69.58 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 123.952 0.901 . . . . 0.0 110.682 177.132 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -56.99 -50.68 71.95 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 123.885 0.874 . . . . 0.0 110.937 -177.404 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.71 -53.03 53.65 Favored 'General case' 0 C--N 1.34 0.17 0 CA-C-O 119.413 -0.327 . . . . 0.0 110.781 178.911 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 9.2 tt -51.13 -45.12 61.52 Favored 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 125.46 1.504 . . . . 0.0 111.175 -178.087 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 15.4 m-70 -75.93 71.51 2.74 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 124.032 0.933 . . . . 0.0 109.562 175.78 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -153.48 141.57 13.9 Favored Pre-proline 0 N--CA 1.453 -0.277 0 C-N-CA 126.464 1.906 . . . . 0.0 106.833 178.191 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_endo -79.77 60.04 7.66 Favored 'Trans proline' 0 N--CA 1.457 -0.655 0 C-N-CA 123.535 2.823 . . . . 0.0 110.359 179.204 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 2.2 t30 66.26 107.09 0.04 OUTLIER 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 127.198 2.199 . . . . 0.0 111.351 177.283 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 75.9 mt -57.12 -65.78 0.56 Allowed 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 123.889 0.876 . . . . 0.0 109.645 178.258 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 43.7 p-10 -159.09 21.39 0.2 Allowed 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 124.199 1.0 . . . . 0.0 111.298 171.912 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 73.8 -52.66 0.69 Allowed 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 126.408 1.883 . . . . 0.0 111.535 -176.986 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -55.4 -68.34 0.2 Allowed 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.944 1.298 . . . . 0.0 110.66 177.958 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 99.9 mm-40 -63.04 -38.56 91.68 Favored 'General case' 0 N--CA 1.457 -0.112 0 C-N-CA 124.2 1.0 . . . . 0.0 110.856 -177.6 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -49.38 -66.3 0.42 Allowed 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 125.044 1.338 . . . . 0.0 110.415 174.239 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 14.4 m-80 -65.43 -38.55 90.24 Favored 'General case' 0 CA--C 1.527 0.082 0 CA-C-O 119.188 -0.434 . . . . 0.0 111.173 -176.668 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -54.36 -47.11 72.97 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 122.931 0.493 . . . . 0.0 111.004 177.78 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 60.1 mttp -59.11 -59.62 5.17 Favored 'General case' 0 C--N 1.342 0.245 0 N-CA-C 109.922 -0.399 . . . . 0.0 109.922 176.602 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 28.4 mm -50.52 -47.07 27.58 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.433 0 C-N-CA 123.794 0.838 . . . . 0.0 111.428 -175.76 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -66.78 -53.4 33.35 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 123.658 0.783 . . . . 0.0 111.607 -179.111 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 89.2 p -60.44 -41.15 93.47 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 123.082 0.553 . . . . 0.0 112.073 -176.738 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 68.0 mt -57.44 -44.42 84.52 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.18 0 C-N-CA 124.759 1.224 . . . . 0.0 110.259 176.073 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 73.6 mtm180 -79.98 57.21 2.57 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 123.273 0.629 . . . . 0.0 110.942 177.255 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 24.9 p-10 . . . . . 0 CA--C 1.532 0.284 0 C-N-CA 125.009 1.324 . . . . 0.0 109.764 171.094 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.733 0 N-CA-C 111.19 0.07 . . . . 0.0 111.19 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 3.8 t 57.97 59.26 0.25 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 C-N-CA 125.498 1.519 . . . . 0.0 110.446 -178.842 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -91.22 148.28 22.46 Favored 'General case' 0 C--N 1.339 0.11 0 C-N-CA 123.034 0.534 . . . . 0.0 109.98 176.704 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 16.3 pt20 -78.03 8.71 4.39 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.386 0.674 . . . . 0.0 112.684 176.401 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 45.2 t -155.4 71.43 0.77 Allowed 'General case' 0 C--N 1.342 0.255 0 C-N-CA 124.914 1.285 . . . . 0.0 107.994 172.853 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 33.5 p90 -75.69 32.44 0.11 Allowed 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 125.506 1.523 . . . . 0.0 114.664 -169.874 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 36.4 m-80 -130.3 -51.74 1.1 Allowed 'General case' 0 C--N 1.332 -0.182 0 C-N-CA 125.439 1.496 . . . . 0.0 108.464 175.063 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 58.3 mtt -72.11 -48.47 43.63 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 123.192 0.597 . . . . 0.0 110.103 175.201 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 18.6 tp60 -75.16 -58.02 3.54 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 178.629 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 34.7 mt-30 -87.11 108.71 19.01 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 -178.412 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -151.08 -49.03 0.12 Allowed 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 125.221 1.408 . . . . 0.0 110.28 178.869 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 15.6 tpt180 -58.85 -36.91 75.35 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 123.124 0.57 . . . . 0.0 111.376 176.516 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -62.13 -49.28 76.51 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 123.065 0.546 . . . . 0.0 110.289 -179.685 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 85.8 m-85 -60.24 -46.09 90.99 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 123.263 0.625 . . . . 0.0 110.991 177.565 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 46.9 t80 -54.96 -48.3 73.37 Favored 'General case' 0 C--N 1.341 0.197 0 C-N-CA 122.934 0.494 . . . . 0.0 110.699 175.475 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -63.48 -46.66 85.17 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 122.709 0.404 . . . . 0.0 110.553 -176.598 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.04 -39.81 95.85 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 124.002 0.921 . . . . 0.0 111.824 178.903 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 66.9 tp -69.02 -48.6 62.56 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 123.515 0.726 . . . . 0.0 110.238 179.148 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 17.3 m-70 -81.84 61.77 5.34 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.292 1.037 . . . . 0.0 109.164 177.631 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 62.1 t0 -146.63 82.62 8.65 Favored Pre-proline 0 CA--C 1.533 0.319 0 C-N-CA 124.886 1.274 . . . . 0.0 108.022 179.33 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -69.09 -25.18 31.94 Favored 'Trans proline' 0 N--CA 1.455 -0.748 0 C-N-CA 123.093 2.529 . . . . 0.0 112.082 -177.346 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 17.8 m-80 -54.28 -48.97 70.65 Favored 'General case' 0 C--N 1.342 0.246 0 C-N-CA 124.248 1.019 . . . . 0.0 109.937 177.998 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -72.24 118.71 15.46 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 107.145 -1.428 . . . . 0.0 107.145 170.124 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 7.0 p-10 -66.68 160.37 25.72 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 123.504 0.722 . . . . 0.0 110.475 178.016 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -75.18 72.6 2.28 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.103 0.961 . . . . 0.0 111.115 -175.252 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.3 tp10 -171.62 -51.22 0.02 OUTLIER 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 127.139 2.175 . . . . 0.0 106.992 175.344 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 36.1 mm-40 -71.15 -45.48 63.45 Favored 'General case' 0 CA--C 1.53 0.184 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 170.51 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 27.6 ttm180 -52.46 -49.12 65.3 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 124.645 1.178 . . . . 0.0 109.926 170.978 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 50.7 t30 -61.42 -42.31 98.54 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.557 0.743 . . . . 0.0 110.783 178.994 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.67 -40.76 88.83 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 122.883 0.473 . . . . 0.0 111.425 177.218 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 62.6 mtpt -59.22 -47.33 85.75 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 118.375 0.534 . . . . 0.0 110.722 175.478 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 33.1 mm -56.78 -53.21 44.94 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.267 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 176.258 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 58.9 mttp -79.3 55.01 1.8 Allowed 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 125.308 1.443 . . . . 0.0 110.376 177.526 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 44.5 t -165.98 -48.63 0.03 OUTLIER 'General case' 0 N--CA 1.456 -0.155 0 C-N-CA 125.625 1.57 . . . . 0.0 108.178 -179.56 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 72.2 mt -54.79 -43.57 67.7 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 171.273 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 13.3 ptp180 -73.33 -49.38 27.74 Favored 'General case' 0 C--N 1.342 0.277 0 CA-C-N 117.982 0.355 . . . . 0.0 111.411 171.243 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -86.63 76.81 9.48 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 124.016 0.926 . . . . 0.0 110.002 -173.616 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 40.9 p-10 . . . . . 0 C--O 1.25 1.092 0 CA-C-O 116.764 -1.589 . . . . 0.0 110.941 179.486 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 0.706 0 N-CA-C 111.641 0.237 . . . . 0.0 111.641 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 13.4 p -75.49 137.88 22.0 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.188 0 C-N-CA 123.365 0.666 . . . . 0.0 109.449 177.048 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -62.14 123.64 18.7 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 123.453 0.701 . . . . 0.0 110.302 -179.598 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 30.5 tp60 -74.65 98.68 3.47 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 108.219 -1.03 . . . . 0.0 108.219 177.89 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 33.3 t -152.1 75.4 1.13 Allowed 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 123.936 0.894 . . . . 0.0 109.846 -174.111 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 15.7 m-30 -83.99 55.53 3.33 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 172.032 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 27.6 m-20 -0.8 -90.96 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 129.57 3.148 . . . . 0.0 114.933 -170.815 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 4.2 mpp? -60.59 -50.1 74.89 Favored 'General case' 0 CA--C 1.529 0.15 0 C-N-CA 123.717 0.807 . . . . 0.0 111.087 -172.695 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 31.0 mm-40 -56.13 -49.19 74.61 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 123.423 0.689 . . . . 0.0 110.429 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 37.0 tt0 -64.97 -39.39 93.41 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 124.654 1.182 . . . . 0.0 111.605 -177.242 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 -57.61 -42.29 82.97 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 123.403 0.681 . . . . 0.0 110.173 172.76 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 6.4 mmp_? -65.91 -32.19 73.55 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-O 118.834 -0.603 . . . . 0.0 112.16 175.267 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 16.7 mmm180 -65.1 -47.59 76.65 Favored 'General case' 0 C--N 1.341 0.232 0 CA-C-N 119.09 0.859 . . . . 0.0 110.836 175.606 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 47.7 m-85 -59.4 -56.11 26.21 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 122.668 0.387 . . . . 0.0 110.751 175.575 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 70.8 t80 -48.03 -52.28 20.66 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 125.626 1.57 . . . . 0.0 110.8 179.138 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 4.4 tm-20 -53.57 -57.9 9.1 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.826 1.25 . . . . 0.0 110.409 175.91 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -53.49 -44.04 68.7 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 124.006 0.922 . . . . 0.0 112.435 -177.866 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 7.1 mp -61.35 -54.32 45.28 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 124.102 0.961 . . . . 0.0 111.283 179.519 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 32.5 m-70 -76.55 -48.14 20.32 Favored 'General case' 0 N--CA 1.457 -0.124 0 N-CA-C 113.046 0.758 . . . . 0.0 113.046 -169.908 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -54.78 113.92 6.1 Favored Pre-proline 0 CA--C 1.535 0.392 0 C-N-CA 124.238 1.015 . . . . 0.0 111.709 -174.288 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -54.95 -40.87 83.59 Favored 'Trans proline' 0 C--N 1.348 0.525 0 C-N-CA 123.481 2.787 . . . . 0.0 112.177 174.34 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 5.0 p30 -57.08 -36.36 70.48 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 123.95 0.9 . . . . 0.0 111.443 177.688 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -80.09 70.74 6.75 Favored 'General case' 0 C--N 1.343 0.31 0 N-CA-C 106.723 -1.584 . . . . 0.0 106.723 169.305 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 8.5 p30 -65.95 168.53 8.0 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 125.208 1.403 . . . . 0.0 110.368 177.415 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -34.59 -64.01 0.27 Allowed 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 126.108 1.763 . . . . 0.0 114.38 -169.95 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -60.6 -38.64 85.33 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 -176.736 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 25.4 mm100 -70.24 -41.26 73.79 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 123.43 0.692 . . . . 0.0 110.807 179.421 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 64.4 ttp85 -60.47 -45.52 93.43 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 124.388 1.075 . . . . 0.0 110.09 175.538 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 4.6 m-80 -62.06 -40.2 94.98 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 122.885 0.474 . . . . 0.0 110.796 175.889 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -62.04 -44.16 97.29 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 118.228 0.467 . . . . 0.0 111.349 176.292 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 10.5 mmmm -57.15 -55.87 29.1 Favored 'General case' 0 C--N 1.342 0.273 0 C-N-CA 123.074 0.549 . . . . 0.0 109.909 174.401 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 75.2 mt -52.66 -48.84 47.75 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.298 0 C-N-CA 123.714 0.806 . . . . 0.0 110.837 -179.887 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 66.5 tttm -60.99 -49.86 75.72 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 123.925 0.89 . . . . 0.0 111.296 -178.728 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 78.6 p -64.77 -41.04 96.18 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 123.2 0.6 . . . . 0.0 111.741 -178.328 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 72.4 mt -59.47 -45.1 94.01 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 C-N-CA 123.543 0.737 . . . . 0.0 109.326 173.48 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 54.0 ttp180 -78.23 58.82 2.14 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 125.139 1.376 . . . . 0.0 109.839 176.813 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -73.58 -50.05 23.2 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 124.237 1.015 . . . . 0.0 110.439 179.645 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 13.2 t70 . . . . . 0 C--O 1.249 1.059 0 CA-C-O 117.362 -1.304 . . . . 0.0 108.485 -177.525 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 0.682 0 N-CA-C 111.661 0.245 . . . . 0.0 111.661 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 73.8 t -67.95 128.47 31.35 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.228 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 -179.664 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -74.66 77.11 2.03 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 124.502 1.121 . . . . 0.0 111.413 -174.144 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 30.5 mt-30 -131.72 -79.3 0.51 Allowed 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 125.499 1.519 . . . . 0.0 108.094 176.287 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 58.3 m -152.49 65.64 0.82 Allowed 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 125.171 1.388 . . . . 0.0 107.466 177.146 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 44.1 p90 -94.8 -14.38 24.72 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 124.488 1.115 . . . . 0.0 113.121 -173.866 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 37.4 t30 -102.71 -87.34 0.42 Allowed 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 123.621 0.768 . . . . 0.0 110.354 -173.424 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 14.1 tpt -85.17 64.41 8.66 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 123.72 0.808 . . . . 0.0 109.522 -174.233 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 9.0 tp-100 -173.17 -61.15 0.02 OUTLIER 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 126.023 1.729 . . . . 0.0 106.631 -177.878 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -85.86 84.48 7.54 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 108.032 -1.099 . . . . 0.0 108.032 173.353 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 15.3 tp60 -154.45 -58.86 0.11 Allowed 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 108.075 -1.083 . . . . 0.0 108.075 179.457 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 3.4 tpm_? -60.66 -45.31 94.6 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 170.105 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 94.8 mtt-85 -54.8 -52.24 63.26 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 124.745 1.218 . . . . 0.0 110.639 177.129 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 21.1 m-85 -59.2 -44.03 92.24 Favored 'General case' 0 C--N 1.34 0.183 0 CA-C-O 119.085 -0.483 . . . . 0.0 111.426 177.789 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 49.3 t80 -59.66 -51.62 69.0 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 118.468 0.576 . . . . 0.0 110.578 178.797 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -55.89 -42.83 76.54 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 123.563 0.745 . . . . 0.0 110.998 179.409 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.77 -57.52 9.69 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.268 0.627 . . . . 0.0 111.576 178.512 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 72.6 mt -60.08 -53.64 55.35 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 124.467 1.107 . . . . 0.0 111.401 -176.481 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 36.6 m-70 -82.64 64.35 7.23 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.156 0.982 . . . . 0.0 109.217 -177.148 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 36.9 t0 -134.32 87.18 33.77 Favored Pre-proline 0 CA--C 1.533 0.301 0 C-N-CA 125.31 1.444 . . . . 0.0 107.949 179.77 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 96.1 Cg_exo -48.01 -43.59 29.89 Favored 'Trans proline' 0 N--CA 1.459 -0.555 0 C-N-CA 124.757 3.638 . . . . 0.0 113.885 -179.12 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 20.3 m120 -60.47 -48.84 80.0 Favored 'General case' 0 CA--C 1.529 0.141 0 C-N-CA 124.04 0.936 . . . . 0.0 111.442 -176.897 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 10.4 mp -75.57 133.28 40.99 Favored 'General case' 0 N--CA 1.456 -0.172 0 C-N-CA 122.938 0.495 . . . . 0.0 109.961 -179.162 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 20.5 p30 -79.41 177.26 8.99 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.517 0.727 . . . . 0.0 111.047 178.414 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -51.55 -48.4 63.09 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 124.432 1.093 . . . . 0.0 112.271 -178.026 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 13.8 tp10 -64.86 -42.87 94.5 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 122.933 0.493 . . . . 0.0 111.173 -178.078 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 65.9 mt-30 -62.36 -41.76 98.86 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 122.863 0.465 . . . . 0.0 110.837 177.735 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 95.5 mtt180 -60.3 -50.73 72.49 Favored 'General case' 0 C--O 1.225 -0.192 0 C-N-CA 122.887 0.475 . . . . 0.0 109.897 174.529 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 78.9 m-20 -53.25 -45.13 68.67 Favored 'General case' 0 C--N 1.341 0.208 0 C-N-CA 123.598 0.759 . . . . 0.0 111.088 178.216 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.75 -43.31 90.25 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 123.559 0.743 . . . . 0.0 111.108 176.734 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 79.2 mttt -59.36 -49.77 76.53 Favored 'General case' 0 C--N 1.341 0.235 0 CA-C-O 118.231 -0.89 . . . . 0.0 111.077 173.359 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 8.3 mm -56.73 -47.58 82.34 Favored 'Isoleucine or valine' 0 C--N 1.343 0.303 0 CA-C-N 119.418 1.008 . . . . 0.0 109.738 -178.337 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 27.3 ttpp -56.63 -45.74 81.37 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.255 1.022 . . . . 0.0 111.63 177.876 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 23.1 t -62.3 -47.44 84.28 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 123.298 0.639 . . . . 0.0 111.009 178.703 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 60.3 mt -60.82 -38.31 78.67 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 C-N-CA 125.005 1.322 . . . . 0.0 110.158 178.72 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 2.4 mmp_? -65.45 -1.04 2.21 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 124.999 1.319 . . . . 0.0 114.345 178.241 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -54.73 -49.35 71.0 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 123.458 0.703 . . . . 0.0 111.518 173.178 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 . . . . . 0 C--O 1.25 1.087 0 CA-C-O 117.539 -1.219 . . . . 0.0 111.013 -179.593 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.78 0 N-CA-C 111.686 0.254 . . . . 0.0 111.686 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 27.4 t -80.01 78.99 1.0 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.239 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 179.372 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -59.03 -40.54 85.35 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 124.211 1.005 . . . . 0.0 111.055 176.22 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 10.6 pt20 -154.42 179.34 9.1 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 124.387 1.075 . . . . 0.0 109.491 176.518 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 7.4 p -78.57 110.36 13.6 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 105.34 -2.096 . . . . 0.0 105.34 169.546 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 51.3 m-85 -79.14 76.59 5.66 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 123.806 0.843 . . . . 0.0 109.876 -171.277 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 42.6 p-10 -43.37 -43.09 4.93 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 126.062 1.745 . . . . 0.0 114.327 179.691 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 28.1 ttt -61.66 -53.57 54.4 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.722 0.809 . . . . 0.0 111.023 179.493 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 26.4 tt0 -62.08 -48.48 80.02 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.315 1.046 . . . . 0.0 110.396 179.219 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 35.8 mt-30 -86.71 20.29 2.6 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 125.95 1.7 . . . . 0.0 111.55 -175.696 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 20.8 tm0? -53.72 -36.97 62.84 Favored 'General case' 0 C--N 1.343 0.314 0 C-N-CA 124.46 1.104 . . . . 0.0 110.131 174.795 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 3.3 mpt_? -63.35 -54.91 29.45 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 123.897 0.879 . . . . 0.0 109.739 179.334 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 19.7 mmm180 -58.58 -47.92 82.67 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 124.04 0.936 . . . . 0.0 110.284 -178.257 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 26.8 t80 -54.55 -48.76 71.65 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 127.367 2.267 . . . . 0.0 111.646 175.874 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 79.7 t80 -65.0 -45.2 86.57 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 124.886 1.274 . . . . 0.0 110.967 -179.573 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -56.46 -51.95 66.51 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.339 0.656 . . . . 0.0 110.081 174.661 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.05 -41.44 87.9 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 124.102 0.961 . . . . 0.0 111.68 179.413 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 49.9 tp -58.56 -46.1 87.58 Favored 'General case' 0 C--N 1.339 0.14 0 C-N-CA 123.759 0.823 . . . . 0.0 110.137 177.643 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 23.0 m-70 -96.67 55.08 1.37 Allowed 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 123.981 0.912 . . . . 0.0 110.148 -178.415 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -142.28 89.17 8.67 Favored Pre-proline 0 CA--C 1.533 0.302 0 C-N-CA 123.816 0.846 . . . . 0.0 109.656 179.346 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_exo -53.48 -30.2 52.8 Favored 'Trans proline' 0 N--CA 1.458 -0.56 0 C-N-CA 124.397 3.398 . . . . 0.0 113.84 175.846 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 11.9 m120 -52.81 -47.71 67.45 Favored 'General case' 0 C--N 1.343 0.316 0 C-N-CA 124.294 1.038 . . . . 0.0 110.707 179.52 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 46.4 mt -69.14 118.45 12.05 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 107.061 -1.459 . . . . 0.0 107.061 169.555 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 12.7 p30 -61.75 156.57 19.99 Favored 'General case' 0 CA--C 1.529 0.155 0 C-N-CA 123.193 0.597 . . . . 0.0 110.96 -178.382 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 9.6 mp0 -47.78 -50.97 24.1 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 125.181 1.393 . . . . 0.0 111.995 -175.778 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -58.37 -59.99 4.49 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 123.104 0.561 . . . . 0.0 111.028 -175.22 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 29.5 mm100 -62.65 -45.56 92.25 Favored 'General case' 0 CA--C 1.529 0.155 0 C-N-CA 123.23 0.612 . . . . 0.0 111.123 -177.405 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 41.2 ttp180 -56.39 -58.93 5.92 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 123.996 0.918 . . . . 0.0 110.372 179.9 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 62.3 m-20 -62.47 -35.27 78.79 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 123.563 0.745 . . . . 0.0 111.343 -176.752 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -62.52 -48.92 77.42 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 122.811 0.444 . . . . 0.0 110.868 175.232 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 59.6 mtpt -59.97 -46.82 88.18 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 123.603 0.761 . . . . 0.0 110.823 178.579 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 24.9 mm -54.41 -57.45 6.18 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.261 0 C-N-CA 123.708 0.803 . . . . 0.0 109.658 174.891 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 82.0 tttt -80.47 59.2 3.42 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.598 1.159 . . . . 0.0 109.787 178.66 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 46.5 t -168.86 -46.32 0.02 OUTLIER 'General case' 0 N--CA 1.456 -0.174 0 C-N-CA 126.507 1.923 . . . . 0.0 107.929 179.824 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 53.2 mt -53.12 -54.21 18.49 Favored 'Isoleucine or valine' 0 C--N 1.342 0.277 0 C-N-CA 123.717 0.807 . . . . 0.0 109.075 169.992 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 9.8 ptp180 -82.28 64.4 6.92 Favored 'General case' 0 C--N 1.342 0.248 0 CA-C-O 121.069 0.461 . . . . 0.0 111.216 175.749 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -69.11 -40.09 78.55 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 123.474 0.71 . . . . 0.0 109.613 169.816 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 30.3 t70 . . . . . 0 C--O 1.25 1.084 0 C-N-CA 125.348 1.459 . . . . 0.0 107.487 177.732 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.725 0 N-CA-C 111.662 0.245 . . . . 0.0 111.662 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 16.5 m -81.91 59.05 0.17 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.363 0 C-N-CA 124.169 0.987 . . . . 0.0 110.532 -179.549 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -78.34 75.64 4.86 Favored 'General case' 0 N--CA 1.456 -0.171 0 C-N-CA 124.074 0.949 . . . . 0.0 109.247 178.528 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 20.7 tp60 70.15 -62.15 0.44 Allowed 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 127.044 2.138 . . . . 0.0 111.688 -176.302 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 94.3 p -159.2 173.01 17.03 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 123.558 0.743 . . . . 0.0 110.77 178.336 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 40.3 p90 -59.23 -36.44 75.44 Favored 'General case' 0 C--N 1.34 0.19 0 C-N-CA 123.837 0.855 . . . . 0.0 112.807 -173.436 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 11.6 t30 -44.97 -43.44 9.06 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 124.906 1.282 . . . . 0.0 112.445 177.465 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 1.8 mpt? -64.59 -46.26 83.48 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 123.528 0.731 . . . . 0.0 110.428 -176.648 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 28.1 mm-40 -63.34 -40.19 96.62 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 122.951 0.501 . . . . 0.0 110.325 175.481 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 80.5 mt-30 -78.4 3.7 15.06 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 124.363 1.065 . . . . 0.0 113.553 -177.099 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 -51.68 -39.06 57.56 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 120.286 1.403 . . . . 0.0 111.451 175.535 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 25.6 mmm180 -56.32 -65.96 0.52 Allowed 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 124.079 0.952 . . . . 0.0 110.778 175.794 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 58.2 mtp180 -50.5 -43.56 55.67 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 125.234 1.413 . . . . 0.0 111.561 178.812 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 80.9 t80 -61.04 -53.8 52.69 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 126.919 2.087 . . . . 0.0 111.695 -177.239 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -72.02 -32.59 67.29 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 118.468 0.576 . . . . 0.0 111.171 -179.75 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 25.5 mm-40 -61.46 -42.39 98.7 Favored 'General case' 0 CA--C 1.532 0.269 0 O-C-N 121.628 -0.67 . . . . 0.0 110.182 172.763 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.35 -47.93 83.64 Favored 'General case' 0 N--CA 1.456 -0.172 0 C-N-CA 123.198 0.599 . . . . 0.0 110.483 176.191 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 34.1 tp -50.6 -44.47 57.04 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.682 1.193 . . . . 0.0 110.991 175.419 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 28.1 m170 -78.54 -40.21 35.62 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 123.751 0.82 . . . . 0.0 113.188 -174.113 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.31 140.89 94.48 Favored Pre-proline 0 CA--C 1.537 0.446 0 CA-C-N 119.056 0.844 . . . . 0.0 111.36 -170.011 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_endo -78.86 -37.83 0.55 Allowed 'Trans proline' 0 N--CA 1.455 -0.78 0 C-N-CA 123.289 2.659 . . . . 0.0 112.43 -178.032 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 3.4 p-10 -58.14 -40.85 82.37 Favored 'General case' 0 C--N 1.341 0.23 0 N-CA-C 113.798 1.036 . . . . 0.0 113.798 -169.808 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 68.2 mt -70.3 117.91 12.45 Favored 'General case' 0 N--CA 1.455 -0.186 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 173.019 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 32.9 p-10 -73.1 176.65 5.63 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 123.376 0.67 . . . . 0.0 110.73 178.779 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.9 mp0 -81.54 55.82 2.77 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 123.645 0.778 . . . . 0.0 109.953 179.507 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 56.5 mt-10 -147.17 -60.92 0.28 Allowed 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 126.881 2.072 . . . . 0.0 105.958 169.974 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 37.2 mm-40 -67.81 -44.08 78.14 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 123.892 0.877 . . . . 0.0 110.439 178.709 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 20.1 ttm180 -58.63 -55.96 28.38 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 123.072 0.549 . . . . 0.0 109.634 177.846 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 22.9 m120 -62.07 -37.91 86.82 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-O 119.158 -0.449 . . . . 0.0 111.374 -177.325 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.3 -48.72 80.58 Favored 'General case' 0 C--N 1.341 0.21 0 CA-C-N 118.239 0.472 . . . . 0.0 110.935 175.906 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 25.0 mmtp -56.73 -56.86 16.13 Favored 'General case' 0 C--N 1.341 0.203 0 C-N-CA 123.127 0.571 . . . . 0.0 110.338 176.421 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 23.1 mm -50.98 -57.74 2.53 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.235 0 C-N-CA 123.948 0.899 . . . . 0.0 110.408 -179.151 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -53.28 -50.38 64.98 Favored 'General case' 0 N--CA 1.456 -0.164 0 C-N-CA 125.065 1.346 . . . . 0.0 111.044 -179.134 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 35.4 t -58.33 -46.26 86.56 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.694 0.798 . . . . 0.0 111.492 -179.09 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 59.6 mt -65.8 -50.13 72.7 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 C-N-CA 123.008 0.523 . . . . 0.0 110.558 -175.875 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 18.5 ptp180 -66.51 -33.72 76.32 Favored 'General case' 0 C--N 1.342 0.272 0 CA-C-N 118.223 0.465 . . . . 0.0 112.044 179.149 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -76.77 69.17 3.1 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 108.5 -0.926 . . . . 0.0 108.5 171.881 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 11.0 t70 . . . . . 0 C--O 1.25 1.081 0 CA-C-O 117.176 -1.392 . . . . 0.0 110.634 -171.607 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.744 0 N-CA-C 111.783 0.29 . . . . 0.0 111.783 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 14.6 t 58.52 70.25 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.342 0 C-N-CA 125.13 1.372 . . . . 0.0 109.756 -178.584 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -79.52 64.72 4.48 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.109 0.964 . . . . 0.0 109.825 178.551 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 7.2 pt20 -65.3 -33.72 76.65 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 124.69 1.196 . . . . 0.0 112.168 -177.962 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 48.5 t -55.52 122.98 12.49 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 123.972 0.909 . . . . 0.0 110.043 -179.369 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -77.57 55.93 1.37 Allowed 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 124.409 1.083 . . . . 0.0 108.285 173.191 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -44.7 -49.59 10.4 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 125.939 1.696 . . . . 0.0 114.289 -169.799 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 28.1 ptm -53.68 -34.4 58.57 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 112.575 0.583 . . . . 0.0 112.575 -178.607 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 75.3 mt-30 -81.72 -60.07 2.38 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 124.168 0.987 . . . . 0.0 109.148 170.468 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 17.6 tt0 -71.36 65.31 0.42 Allowed 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 128.315 2.646 . . . . 0.0 110.725 -177.705 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 19.1 tp60 -163.54 -56.91 0.04 OUTLIER 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 124.435 1.094 . . . . 0.0 110.059 179.288 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 30.9 tpt180 -72.39 -77.98 0.09 Allowed 'General case' 0 C--N 1.341 0.227 0 C-N-CA 122.854 0.461 . . . . 0.0 110.895 -172.701 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.77 -26.83 66.03 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 122.672 0.389 . . . . 0.0 111.562 178.733 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 76.3 t80 -61.22 -56.66 18.12 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 126.425 1.89 . . . . 0.0 110.514 175.486 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 55.7 t80 -58.47 -49.64 76.63 Favored 'General case' 0 C--N 1.341 0.207 0 C-N-CA 122.649 0.38 . . . . 0.0 110.215 176.79 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -56.89 -44.73 82.61 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 122.838 0.455 . . . . 0.0 111.451 -177.827 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.95 -53.87 52.76 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 123.589 0.755 . . . . 0.0 111.49 179.719 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 55.1 tp -63.45 -52.67 60.43 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 122.766 0.426 . . . . 0.0 110.554 -178.991 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 24.8 m-70 -81.43 64.39 6.13 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 124.465 1.106 . . . . 0.0 109.696 -179.084 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -150.82 115.25 3.22 Favored Pre-proline 0 CA--C 1.533 0.302 0 C-N-CA 124.89 1.276 . . . . 0.0 108.181 175.853 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 94.4 Cg_endo -77.82 -25.11 8.01 Favored 'Trans proline' 0 N--CA 1.455 -0.754 0 C-N-CA 123.249 2.633 . . . . 0.0 112.052 -177.85 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 -56.13 -55.18 36.18 Favored 'General case' 0 C--N 1.342 0.265 0 C-N-CA 123.775 0.83 . . . . 0.0 110.619 -178.796 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 91.0 mt -79.41 141.37 36.9 Favored 'General case' 0 N--CA 1.453 -0.28 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 172.64 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 43.8 p-10 -96.68 176.51 5.98 Favored 'General case' 0 C--O 1.233 0.189 0 C-N-CA 124.493 1.117 . . . . 0.0 110.396 179.485 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -79.37 62.4 3.7 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 124.123 0.969 . . . . 0.0 110.453 175.514 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 64.8 mt-10 -148.2 -47.27 0.16 Allowed 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 127.18 2.192 . . . . 0.0 106.794 169.773 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 22.9 mm100 -80.34 -56.65 4.05 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 124.063 0.945 . . . . 0.0 109.71 173.365 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 21.7 ptt180 -68.0 -41.83 81.66 Favored 'General case' 0 C--N 1.341 0.23 0 CA-C-O 119.526 -0.273 . . . . 0.0 111.151 -173.722 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 43.2 p-10 -62.93 -35.81 81.32 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 117.951 0.341 . . . . 0.0 111.622 -178.112 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -60.73 -44.81 96.18 Favored 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 123.687 0.795 . . . . 0.0 110.567 175.199 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 57.0 mtmt -61.44 -48.91 79.0 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-O 119.423 -0.322 . . . . 0.0 110.712 175.729 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 27.9 mm -55.93 -45.02 79.86 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 C-N-CA 124.056 0.942 . . . . 0.0 111.326 179.294 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 88.6 mttt -61.5 -47.43 85.68 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 123.704 0.801 . . . . 0.0 110.689 175.425 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 23.1 t -61.92 -43.57 98.57 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 123.915 0.886 . . . . 0.0 112.012 -177.589 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 58.4 mt -61.59 -35.58 68.0 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.222 0 C-N-CA 124.102 0.961 . . . . 0.0 109.905 177.401 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 85.3 mtm180 -78.31 52.59 1.15 Allowed 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.27 0.628 . . . . 0.0 111.479 173.248 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -83.71 -31.46 26.04 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 124.491 1.116 . . . . 0.0 109.445 169.579 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 28.4 t70 . . . . . 0 C--O 1.252 1.202 0 C-N-CA 125.337 1.455 . . . . 0.0 108.124 -179.164 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.744 0 N-CA-C 111.671 0.248 . . . . 0.0 111.671 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 15.6 m -82.33 49.12 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.457 0 C-N-CA 124.401 1.081 . . . . 0.0 111.021 -179.409 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -78.51 107.31 11.07 Favored 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 124.32 1.048 . . . . 0.0 109.371 -179.153 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 16.9 tt0 55.89 50.25 14.35 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 124.58 1.152 . . . . 0.0 110.174 -175.795 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 40.6 t -94.77 170.56 9.36 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 124.919 1.288 . . . . 0.0 109.314 177.826 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 69.3 m-85 -75.1 70.42 2.07 Favored 'General case' 0 C--N 1.34 0.181 0 C-N-CA 124.649 1.179 . . . . 0.0 110.988 -177.305 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 4.3 p-10 -179.19 -40.71 0.01 OUTLIER 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 128.432 2.693 . . . . 0.0 107.695 -175.007 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 20.6 mmt -76.68 -51.03 12.26 Favored 'General case' 0 C--N 1.341 0.234 0 N-CA-C 107.386 -1.339 . . . . 0.0 107.386 169.41 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 49.6 mt-30 -54.56 -47.44 73.24 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 124.602 1.161 . . . . 0.0 109.769 172.341 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 26.8 mt-30 -89.8 18.24 5.82 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.304 1.041 . . . . 0.0 112.061 -176.077 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 11.9 tp-100 -66.38 -46.08 77.87 Favored 'General case' 0 C--N 1.341 0.23 0 CA-C-N 118.944 0.793 . . . . 0.0 110.042 179.638 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 9.1 mmm180 -58.4 -36.59 73.79 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.785 0.834 . . . . 0.0 111.426 173.042 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 12.0 mmp_? -68.52 -37.22 79.84 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 123.581 0.753 . . . . 0.0 110.534 179.634 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 15.6 m-30 -65.29 -48.86 71.67 Favored 'General case' 0 N--CA 1.455 -0.196 0 CA-C-O 119.428 -0.32 . . . . 0.0 110.157 172.198 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 21.3 m-85 -79.39 60.27 3.12 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 123.904 0.882 . . . . 0.0 109.987 175.716 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.7 tm-20 -175.57 -50.33 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 127.182 2.193 . . . . 0.0 106.99 -174.996 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -73.8 -53.03 11.18 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 124.179 0.992 . . . . 0.0 110.896 175.856 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 58.5 tp -73.4 -54.89 7.22 Favored 'General case' 0 C--N 1.34 0.166 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 175.157 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 56.0 m-70 -84.01 59.78 5.48 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 123.423 0.689 . . . . 0.0 109.696 178.898 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -94.57 137.62 22.53 Favored Pre-proline 0 CA--C 1.533 0.322 0 C-N-CA 124.439 1.096 . . . . 0.0 108.239 174.531 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_exo -42.43 -52.94 4.01 Favored 'Trans proline' 0 N--CA 1.458 -0.59 0 C-N-CA 124.004 3.136 . . . . 0.0 114.136 173.954 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 5.9 p-10 -160.31 131.94 5.95 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 123.621 0.768 . . . . 0.0 110.54 -179.573 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 92.8 mt -140.5 -126.95 0.11 Allowed 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 125.4 1.48 . . . . 0.0 107.104 172.704 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 51.6 p-10 -155.07 23.58 0.43 Allowed 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.768 0.827 . . . . 0.0 111.957 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 74.17 -54.28 0.68 Allowed 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 125.91 1.684 . . . . 0.0 112.109 -177.47 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -52.58 -59.64 4.22 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 124.465 1.106 . . . . 0.0 110.24 178.067 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 83.8 mt-30 -58.82 -43.31 90.57 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 124.803 1.241 . . . . 0.0 110.897 178.652 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 59.2 ttm-85 -55.51 -54.98 37.13 Favored 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 124.807 1.243 . . . . 0.0 111.218 -177.502 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 28.8 m-80 -71.23 -38.16 71.99 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 123.061 0.544 . . . . 0.0 111.146 179.804 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.19 -43.74 87.69 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 118.434 0.561 . . . . 0.0 111.233 177.954 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 58.6 mtpt -59.59 -50.99 71.76 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 123.129 0.571 . . . . 0.0 109.929 175.709 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 11.6 mm -52.99 -51.75 35.23 Favored 'Isoleucine or valine' 0 C--N 1.341 0.226 0 C-N-CA 123.019 0.527 . . . . 0.0 111.045 178.963 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 67.6 mttm -57.68 -49.63 75.85 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 123.527 0.731 . . . . 0.0 110.878 179.683 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 32.5 t -57.77 -51.29 70.16 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 124.072 0.949 . . . . 0.0 111.472 -179.119 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 67.1 mt -58.97 -58.26 7.66 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.223 0 C-N-CA 124.765 1.226 . . . . 0.0 109.435 179.722 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 61.1 ttm-85 -55.44 -42.28 73.99 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 125.136 1.374 . . . . 0.0 111.39 -175.721 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -77.39 68.56 3.52 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 123.957 0.903 . . . . 0.0 109.249 172.762 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 18.4 t70 . . . . . 0 C--O 1.25 1.124 0 CA-C-O 117.172 -1.394 . . . . 0.0 110.041 -178.696 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.741 0 N-CA-C 111.757 0.28 . . . . 0.0 111.757 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 42.6 t -78.59 84.11 1.03 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 179.335 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -154.55 151.33 28.75 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 124.776 1.231 . . . . 0.0 108.9 178.881 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 42.5 tt0 54.83 46.28 24.83 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 124.568 1.147 . . . . 0.0 110.76 -178.673 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 15.1 t -74.9 -8.47 56.57 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 123.561 0.744 . . . . 0.0 112.888 -176.327 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 47.8 p90 -69.11 -29.53 67.63 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 123.21 0.604 . . . . 0.0 111.096 176.26 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 32.9 m120 -76.72 59.54 1.57 Allowed 'General case' 0 C--N 1.343 0.29 0 C-N-CA 123.882 0.873 . . . . 0.0 110.563 170.344 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 95.1 mtp -143.91 -60.64 0.4 Allowed 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 127.478 2.311 . . . . 0.0 105.868 171.053 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 49.5 mm-40 -60.54 -43.75 96.85 Favored 'General case' 0 C--N 1.341 0.22 0 C-N-CA 124.275 1.03 . . . . 0.0 110.468 170.746 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 17.4 mm100 -56.51 -48.48 77.12 Favored 'General case' 0 C--O 1.225 -0.228 0 CA-C-O 119.092 -0.48 . . . . 0.0 110.747 176.026 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 16.1 mm100 -67.3 -38.64 85.32 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 123.753 0.821 . . . . 0.0 111.447 -177.188 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 4.0 tmt_? -62.84 -54.95 30.93 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 124.432 1.093 . . . . 0.0 110.265 176.531 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 89.4 mtt-85 -67.56 -32.73 73.7 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 124.067 0.947 . . . . 0.0 111.185 -177.144 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 3.5 t80 -56.98 -53.79 54.06 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 125.275 1.43 . . . . 0.0 110.294 169.953 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 70.9 t80 -57.42 -48.06 80.13 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 123.377 0.671 . . . . 0.0 110.724 179.747 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 73.2 mt-10 -56.13 -50.02 72.28 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 123.119 0.568 . . . . 0.0 111.077 175.791 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -56.81 -45.09 82.49 Favored 'General case' 0 C--N 1.341 0.207 0 C-N-CA 124.138 0.975 . . . . 0.0 111.462 179.97 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 1.1 tt -50.8 -41.26 57.05 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 124.454 1.102 . . . . 0.0 109.95 175.01 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 11.9 m-70 -100.52 25.64 7.53 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 124.437 1.095 . . . . 0.0 112.678 -176.169 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 80.0 m-20 -69.05 151.98 96.97 Favored Pre-proline 0 CA--C 1.538 0.486 0 CA-C-N 119.13 0.877 . . . . 0.0 109.946 174.884 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_exo -50.75 -63.64 0.27 Allowed 'Trans proline' 0 C--N 1.351 0.663 0 C-N-CA 123.962 3.108 . . . . 0.0 114.46 -173.831 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 -162.96 84.61 0.52 Allowed 'General case' 0 N--CA 1.456 -0.141 0 C-N-CA 123.189 0.596 . . . . 0.0 109.572 -176.077 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 89.6 mt -122.94 129.24 51.33 Favored 'General case' 0 N--CA 1.456 -0.135 0 N-CA-C 106.267 -1.753 . . . . 0.0 106.267 172.747 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 1.7 p30 -69.24 163.93 23.88 Favored 'General case' 0 CA--C 1.529 0.157 0 N-CA-C 112.883 0.697 . . . . 0.0 112.883 -169.533 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 -58.02 -28.52 64.52 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 124.372 1.069 . . . . 0.0 113.074 -172.002 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -57.64 -50.29 73.66 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 119.069 0.849 . . . . 0.0 109.902 173.903 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 47.5 mt-30 -65.39 -40.13 93.07 Favored 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 124.278 1.031 . . . . 0.0 110.378 -179.885 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 5.8 mmp_? -62.25 -65.0 0.75 Allowed 'General case' 0 C--N 1.342 0.257 0 N-CA-C 109.244 -0.651 . . . . 0.0 109.244 177.896 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 61.2 t30 -50.14 -38.7 40.47 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 124.909 1.284 . . . . 0.0 112.368 -176.986 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -54.6 -49.25 70.91 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 118.297 0.499 . . . . 0.0 111.103 174.013 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 95.5 mttt -62.54 -55.87 23.35 Favored 'General case' 0 C--N 1.342 0.241 0 CA-C-O 118.938 -0.553 . . . . 0.0 110.807 173.831 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 4.9 mm -57.73 -37.96 62.4 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 CA-C-N 118.294 0.497 . . . . 0.0 110.499 -171.056 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 17.6 tppt? -60.2 -50.98 71.51 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 124.265 1.026 . . . . 0.0 110.453 176.701 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 18.1 m -59.55 -44.96 93.09 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.59 0.756 . . . . 0.0 111.037 179.067 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 48.8 mt -62.69 -47.72 91.57 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 C-N-CA 125.386 1.474 . . . . 0.0 110.226 -179.347 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 78.4 mtm180 -56.91 -46.53 81.92 Favored 'General case' 0 C--N 1.34 0.193 0 C-N-CA 123.77 0.828 . . . . 0.0 110.282 174.325 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 53.0 m-20 -85.67 43.59 1.04 Allowed 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.773 0.829 . . . . 0.0 110.992 -178.846 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 39.1 t70 . . . . . 0 C--O 1.25 1.084 0 CA-C-O 117.013 -1.47 . . . . 0.0 109.145 177.11 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.728 0 CA-C-O 120.01 -0.043 . . . . 0.0 111.046 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 18.9 m -72.34 156.92 6.75 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.228 0 C-N-CA 122.879 0.472 . . . . 0.0 110.979 -178.065 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -71.28 153.04 42.71 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 123.508 0.723 . . . . 0.0 110.977 -179.601 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 55.1 mm-40 53.65 51.33 15.28 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 125.44 1.496 . . . . 0.0 111.296 -179.658 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 30.7 t -151.93 -98.71 0.06 Allowed 'General case' 0 N--CA 1.455 -0.21 0 N-CA-C 108.177 -1.046 . . . . 0.0 108.177 -179.048 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 95.5 m-85 -46.14 -39.79 10.09 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 126.268 1.827 . . . . 0.0 111.251 173.867 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 7.4 m120 -31.46 -48.52 0.14 Allowed 'General case' 0 CA--C 1.529 0.165 0 C-N-CA 128.151 2.58 . . . . 0.0 113.0 170.294 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -59.88 -52.5 65.17 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 123.386 0.674 . . . . 0.0 110.296 -178.667 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 47.9 mm-40 -60.41 -48.31 82.32 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 124.078 0.951 . . . . 0.0 110.592 178.756 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 16.6 mm100 -54.23 -55.83 24.27 Favored 'General case' 0 C--N 1.341 0.21 0 C-N-CA 124.502 1.121 . . . . 0.0 110.557 179.726 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 62.0 mm-40 -59.35 -39.57 83.62 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 124.015 0.926 . . . . 0.0 111.63 179.25 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 9.7 mmm180 -58.95 -56.91 16.11 Favored 'General case' 0 N--CA 1.456 -0.167 0 CA-C-N 118.143 0.428 . . . . 0.0 110.909 176.406 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 19.8 ptt180 -66.07 -30.69 71.25 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 112.557 0.577 . . . . 0.0 112.557 -177.582 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 15.5 m-85 -58.69 -52.01 67.52 Favored 'General case' 0 C--N 1.343 0.311 0 CA-C-N 118.494 0.588 . . . . 0.0 110.344 169.874 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 47.5 t80 -58.37 -48.65 79.94 Favored 'General case' 0 C--N 1.341 0.203 0 C-N-CA 122.994 0.517 . . . . 0.0 110.657 -179.807 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -56.99 -46.99 81.87 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 123.355 0.662 . . . . 0.0 111.03 -179.742 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.62 -54.09 44.82 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 123.402 0.681 . . . . 0.0 111.514 178.716 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 61.3 tp -59.86 -45.77 91.39 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 124.572 1.149 . . . . 0.0 111.215 -176.428 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 22.9 m-70 -89.28 16.24 7.71 Favored 'General case' 0 CA--C 1.537 0.481 0 C-N-CA 124.309 1.043 . . . . 0.0 111.994 -179.617 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -68.22 135.45 91.33 Favored Pre-proline 0 CA--C 1.533 0.311 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 172.863 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -67.67 -29.16 36.61 Favored 'Trans proline' 0 N--CA 1.457 -0.651 0 C-N-CA 122.456 2.104 . . . . 0.0 112.668 -176.39 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 27.5 m-80 -83.1 62.88 6.84 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.685 0.794 . . . . 0.0 110.516 -175.884 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 20.7 mt -80.3 87.1 5.6 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-O 121.683 0.754 . . . . 0.0 110.234 177.794 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 52.3 p-10 -98.7 17.36 19.47 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 125.602 1.561 . . . . 0.0 110.775 171.413 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.9 mp0 71.46 -55.98 0.64 Allowed 'General case' 0 C--N 1.345 0.408 0 C-N-CA 127.223 2.209 . . . . 0.0 111.277 -174.035 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -45.24 -54.03 7.55 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 126.246 1.819 . . . . 0.0 112.219 -178.191 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 37.1 mt-30 -60.52 -54.13 49.15 Favored 'General case' 0 C--N 1.34 0.176 0 C-N-CA 123.301 0.641 . . . . 0.0 110.56 -176.34 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 78.3 ttt180 -54.33 -56.19 20.99 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 124.117 0.967 . . . . 0.0 110.998 -179.253 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 11.4 m-80 -59.74 -50.3 74.38 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 122.939 0.495 . . . . 0.0 110.854 -177.537 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -54.64 -50.21 68.69 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 123.262 0.625 . . . . 0.0 111.409 -179.828 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 27.1 mmmt -61.39 -54.02 49.1 Favored 'General case' 0 N--CA 1.454 -0.225 0 C-N-CA 122.769 0.428 . . . . 0.0 110.83 179.603 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 39.7 mt -54.87 -46.53 75.68 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 C-N-CA 123.282 0.633 . . . . 0.0 110.999 -178.159 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 60.9 mtpt -58.16 -48.25 80.85 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 123.888 0.875 . . . . 0.0 110.972 176.227 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 50.3 m -58.29 -52.7 64.49 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 117.917 0.326 . . . . 0.0 111.121 179.13 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 41.1 mt -63.37 -49.06 84.38 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.251 0 C-N-CA 124.312 1.045 . . . . 0.0 110.751 -173.891 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 12.3 ptm180 -64.81 -34.79 79.2 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 118.018 0.372 . . . . 0.0 111.634 -177.087 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 84.1 m-20 -68.54 -48.62 63.84 Favored 'General case' 0 C--N 1.341 0.237 0 C-N-CA 122.761 0.424 . . . . 0.0 110.235 175.539 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 34.3 t70 . . . . . 0 C--O 1.251 1.178 0 CA-C-O 117.459 -1.258 . . . . 0.0 109.403 178.522 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.762 0 N-CA-C 111.72 0.267 . . . . 0.0 111.72 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 22.8 t -72.24 81.26 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.353 0 C-N-CA 123.831 0.852 . . . . 0.0 109.013 179.467 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -152.02 -67.57 0.17 Allowed 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 124.677 1.191 . . . . 0.0 108.817 -179.738 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.86 58.07 2.75 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.19 0.996 . . . . 0.0 110.838 178.16 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 59.0 m -130.79 54.85 1.87 Allowed 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 107.007 -1.479 . . . . 0.0 107.007 -178.589 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 18.0 m-85 -79.51 69.78 5.84 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 124.931 1.292 . . . . 0.0 108.475 -179.06 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 10.6 m120 -77.84 54.79 1.31 Allowed 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 125.271 1.428 . . . . 0.0 112.706 -169.899 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 62.6 mtt -149.21 -52.75 0.16 Allowed 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 128.726 2.81 . . . . 0.0 105.737 174.995 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 48.3 mt-30 -64.12 -56.74 12.73 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 125.343 1.457 . . . . 0.0 108.499 169.679 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 90.0 mt-30 -64.39 -20.74 66.33 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 125.537 1.535 . . . . 0.0 112.154 176.617 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 11.5 tt0 -60.23 -32.56 71.24 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 118.876 0.762 . . . . 0.0 111.398 177.254 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 5.1 mmp_? -64.14 -47.02 81.53 Favored 'General case' 0 N--CA 1.456 -0.151 0 C-N-CA 123.245 0.618 . . . . 0.0 110.12 173.858 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 79.4 mtt85 -60.49 -44.33 96.07 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 123.42 0.688 . . . . 0.0 110.139 178.151 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 14.1 m-30 -57.67 -45.71 85.23 Favored 'General case' 0 C--O 1.225 -0.215 0 C-N-CA 123.562 0.745 . . . . 0.0 111.592 174.982 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 87.0 t80 -58.43 -52.27 66.34 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 118.648 0.658 . . . . 0.0 110.373 178.795 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -56.9 -52.41 65.25 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.564 0.746 . . . . 0.0 111.178 179.841 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.23 -51.13 70.87 Favored 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 124.739 1.216 . . . . 0.0 111.555 -178.004 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 59.6 tp -62.11 -50.2 72.87 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 124.541 1.136 . . . . 0.0 110.34 -177.548 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 18.0 m-70 -82.17 62.78 6.06 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.8 0.84 . . . . 0.0 109.674 178.008 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -154.43 121.93 2.89 Favored Pre-proline 0 CA--C 1.535 0.371 0 C-N-CA 123.916 0.886 . . . . 0.0 109.414 176.491 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo -80.06 -32.75 1.31 Allowed 'Trans proline' 0 N--CA 1.456 -0.735 0 C-N-CA 123.458 2.772 . . . . 0.0 112.319 -178.311 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 30.3 t30 -53.52 -47.88 69.52 Favored 'General case' 0 C--N 1.343 0.298 0 C-N-CA 124.231 1.012 . . . . 0.0 110.923 -176.246 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -75.87 88.51 2.88 Favored 'General case' 0 N--CA 1.455 -0.219 0 N-CA-C 105.272 -2.121 . . . . 0.0 105.272 169.5 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 -81.69 55.45 2.7 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.532 1.133 . . . . 0.0 112.811 -169.639 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 15.3 tt0 69.88 164.94 0.27 Allowed 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.879 1.272 . . . . 0.0 110.969 -179.353 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.9 tp10 71.8 -64.01 0.4 Allowed 'General case' 0 N--CA 1.456 -0.163 0 C-N-CA 127.031 2.132 . . . . 0.0 110.775 -178.033 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 33.4 mm-40 -59.58 -45.39 92.02 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 124.341 1.057 . . . . 0.0 109.631 171.976 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 39.3 ttp180 -56.13 -53.32 58.51 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 125.684 1.594 . . . . 0.0 110.513 176.934 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 9.8 m120 -61.81 -43.45 98.82 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 124.467 1.107 . . . . 0.0 110.742 -179.579 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -60.83 -51.23 70.18 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 124.081 0.952 . . . . 0.0 111.206 -178.541 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 61.1 pttt -66.52 -34.9 78.95 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 118.345 0.52 . . . . 0.0 111.594 -178.101 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 5.3 mt -58.95 -48.08 87.67 Favored 'Isoleucine or valine' 0 C--N 1.342 0.251 0 CA-C-O 118.962 -0.542 . . . . 0.0 109.84 170.407 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 52.0 tptt -60.95 -37.32 81.93 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 118.754 0.706 . . . . 0.0 111.435 179.228 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 19.4 m -59.61 -41.63 90.78 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 118.507 0.594 . . . . 0.0 111.188 174.948 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 70.7 mt -65.61 -60.61 2.44 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.453 0 C-N-CA 123.831 0.852 . . . . 0.0 109.709 177.907 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 3.5 ptm180 -92.09 69.47 5.31 Favored 'General case' 0 C--N 1.341 0.219 0 C-N-CA 123.783 0.833 . . . . 0.0 110.191 174.197 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -82.1 59.84 4.6 Favored 'General case' 0 CA--C 1.532 0.253 0 N-CA-C 109.91 -0.404 . . . . 0.0 109.91 178.954 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 . . . . . 0 C--O 1.251 1.15 0 CA-C-O 117.517 -1.23 . . . . 0.0 110.645 -179.092 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 0.718 0 N-CA-C 111.921 0.341 . . . . 0.0 111.921 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 35.3 m -65.39 159.64 3.97 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 C-N-CA 123.603 0.761 . . . . 0.0 110.937 179.033 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -79.39 64.32 4.25 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 124.121 0.968 . . . . 0.0 111.083 -177.269 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 64.1 tp60 -153.52 57.96 0.75 Allowed 'General case' 0 N--CA 1.454 -0.268 0 N-CA-C 107.464 -1.309 . . . . 0.0 107.464 173.308 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 87.3 p -138.11 47.55 2.01 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 124.914 1.286 . . . . 0.0 107.959 -176.896 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 9.4 m-85 -80.23 67.6 6.11 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 124.81 1.244 . . . . 0.0 108.101 178.58 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 36.5 p-10 -30.7 -56.61 0.21 Allowed 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 126.794 2.038 . . . . 0.0 114.576 -173.325 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 96.4 mtp -80.88 58.74 3.48 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.346 1.058 . . . . 0.0 110.823 179.89 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 23.2 tt0 177.55 -57.9 0.01 OUTLIER 'General case' 0 CA--C 1.529 0.147 0 C-N-CA 127.755 2.422 . . . . 0.0 106.352 -178.259 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 29.1 mm100 -54.08 -34.88 61.32 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 125.218 1.407 . . . . 0.0 112.012 176.686 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -36.42 -41.11 0.27 Allowed 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 125.937 1.695 . . . . 0.0 114.204 177.673 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 33.3 tpt85 -69.97 -53.98 15.33 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.352 0.661 . . . . 0.0 111.075 -178.738 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 9.8 mpt_? -61.47 -47.29 86.37 Favored 'General case' 0 CA--C 1.53 0.212 0 C-N-CA 124.446 1.098 . . . . 0.0 109.577 -178.912 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 88.4 t80 -49.42 -51.64 33.96 Favored 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 127.709 2.403 . . . . 0.0 111.33 172.67 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 40.7 t80 -58.41 -47.41 84.01 Favored 'General case' 0 C--N 1.341 0.197 0 CA-C-O 119.019 -0.515 . . . . 0.0 110.803 177.388 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 46.4 mm-40 -58.43 -51.69 68.75 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 118.68 0.673 . . . . 0.0 110.69 178.909 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -56.45 -45.59 80.76 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 124.374 1.07 . . . . 0.0 111.72 -178.994 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 57.7 tp -64.87 -53.47 46.11 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 123.9 0.88 . . . . 0.0 110.384 178.506 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 16.8 m-70 -82.28 57.99 3.86 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 124.643 1.177 . . . . 0.0 109.877 -179.782 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -156.51 78.02 4.15 Favored Pre-proline 0 CA--C 1.534 0.356 0 C-N-CA 124.904 1.282 . . . . 0.0 107.79 178.266 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -82.47 59.08 6.78 Favored 'Trans proline' 0 N--CA 1.456 -0.683 0 C-N-CA 124.323 3.349 . . . . 0.0 110.568 -172.659 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 3.1 p-10 -154.47 -30.9 0.11 Allowed 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 124.806 1.242 . . . . 0.0 111.556 -176.372 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -62.83 153.61 32.55 Favored 'General case' 0 C--N 1.343 0.293 0 CA-C-N 118.742 0.701 . . . . 0.0 109.995 170.782 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 8.9 p30 -65.92 132.48 48.73 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 175.247 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -80.76 65.27 5.84 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 124.276 1.03 . . . . 0.0 108.585 -178.295 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.9 tp10 -152.07 -52.59 0.12 Allowed 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 126.805 2.042 . . . . 0.0 106.636 179.515 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 35.0 mt-30 -63.62 -65.45 0.68 Allowed 'General case' 0 C--N 1.341 0.218 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 171.678 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 18.7 ptt180 -61.59 -33.62 74.2 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-O 119.075 -0.488 . . . . 0.0 111.728 178.266 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 24.5 t-20 -63.88 -49.4 72.87 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 118.482 0.583 . . . . 0.0 111.191 179.031 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.34 -47.55 83.42 Favored 'General case' 0 C--N 1.339 0.15 0 C-N-CA 123.552 0.741 . . . . 0.0 110.864 178.159 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 57.8 mtpt -56.36 -61.19 2.57 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 123.51 0.724 . . . . 0.0 110.176 177.266 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 38.5 mt -49.89 -53.0 11.85 Favored 'Isoleucine or valine' 0 C--N 1.338 0.076 0 C-N-CA 124.946 1.298 . . . . 0.0 110.994 -178.843 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 6.9 ttpm? -53.37 -54.05 42.3 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 124.429 1.092 . . . . 0.0 111.311 178.86 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 51.0 m -56.82 -48.12 78.72 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 122.656 0.382 . . . . 0.0 111.647 179.883 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 67.4 mt -62.27 -50.83 78.39 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.267 0 C-N-CA 124.314 1.046 . . . . 0.0 110.697 -175.278 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 36.2 ptt85 -71.93 -31.85 66.77 Favored 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 112.484 0.55 . . . . 0.0 112.484 -177.301 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 87.6 m-20 -69.3 -45.25 70.04 Favored 'General case' 0 C--N 1.341 0.226 0 CA-C-N 118.212 0.46 . . . . 0.0 110.855 178.689 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 . . . . . 0 C--O 1.251 1.161 0 CA-C-O 116.728 -1.606 . . . . 0.0 110.287 -175.691 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 0.689 0 N-CA-C 111.73 0.27 . . . . 0.0 111.73 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 21.9 t -78.49 72.23 0.54 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 C-N-CA 124.104 0.961 . . . . 0.0 108.718 -179.737 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -165.33 -68.26 0.03 OUTLIER 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 125.767 1.627 . . . . 0.0 107.106 178.365 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -83.8 63.48 7.52 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.829 0.852 . . . . 0.0 109.086 171.113 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 23.0 t -136.67 56.74 1.79 Allowed 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 107.346 -1.353 . . . . 0.0 107.346 178.736 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 24.3 m-85 -79.82 70.4 6.35 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 124.895 1.278 . . . . 0.0 108.369 179.323 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -61.84 66.11 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 127.714 2.405 . . . . 0.0 115.247 -169.708 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 37.2 tpp -179.39 -45.88 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 128.638 2.775 . . . . 0.0 107.185 179.22 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 28.3 mp0 -75.74 -43.3 47.48 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 125.757 1.623 . . . . 0.0 109.404 173.206 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 12.5 mm100 -49.65 -41.58 43.07 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 125.654 1.582 . . . . 0.0 111.157 173.712 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 82.2 mt-30 -53.35 -42.49 66.87 Favored 'General case' 0 C--N 1.34 0.182 0 C-N-CA 124.317 1.047 . . . . 0.0 111.337 177.362 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 80.4 mmt-85 -64.26 -42.05 96.65 Favored 'General case' 0 N--CA 1.456 -0.165 0 C-N-CA 123.4 0.68 . . . . 0.0 110.611 -178.16 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.48 -40.25 95.32 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-O 119.546 -0.264 . . . . 0.0 110.54 173.951 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 20.6 m-85 -62.66 -34.07 76.34 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-O 118.716 -0.659 . . . . 0.0 111.496 175.673 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 19.5 m-85 -76.72 55.12 1.03 Allowed 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 119.075 0.852 . . . . 0.0 110.342 172.449 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -178.56 -55.93 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 127.183 2.193 . . . . 0.0 107.676 -179.034 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -80.53 -47.52 14.12 Favored 'General case' 0 C--N 1.34 0.185 0 C-N-CA 123.951 0.9 . . . . 0.0 111.579 -179.366 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.0 tt -78.01 -56.49 4.44 Favored 'General case' 0 C--N 1.338 0.072 0 N-CA-C 107.956 -1.127 . . . . 0.0 107.956 -178.079 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 62.7 m-70 -84.45 54.41 2.99 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 124.422 1.089 . . . . 0.0 109.392 176.95 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -87.45 141.55 32.46 Favored Pre-proline 0 CA--C 1.533 0.318 0 C-N-CA 123.649 0.779 . . . . 0.0 109.785 -179.818 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_exo -43.52 -59.97 0.9 Allowed 'Trans proline' 0 N--CA 1.455 -0.771 0 C-N-CA 124.212 3.275 . . . . 0.0 115.343 173.015 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 9.4 p30 -157.53 25.91 0.29 Allowed 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 115.001 1.482 . . . . 0.0 115.001 -169.969 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 28.5 mt -63.1 133.24 54.14 Favored 'General case' 0 C--N 1.34 0.182 0 CA-C-N 119.647 1.112 . . . . 0.0 109.375 169.974 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 14.2 p30 -65.05 163.82 14.05 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 123.715 0.806 . . . . 0.0 110.527 175.847 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -51.48 -49.11 62.46 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 124.05 0.94 . . . . 0.0 112.314 -175.046 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -58.2 -57.23 13.79 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.312 0.645 . . . . 0.0 110.959 -177.331 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 92.0 mm-40 -66.62 -43.47 84.67 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 123.073 0.549 . . . . 0.0 111.495 -175.217 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 22.3 ttm-85 -56.02 -54.55 43.54 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.761 0.824 . . . . 0.0 109.619 175.889 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -57.17 -40.7 77.81 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 123.877 0.871 . . . . 0.0 111.624 178.282 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -60.42 -45.59 93.07 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 123.061 0.544 . . . . 0.0 111.088 178.429 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 12.3 mmmm -58.75 -47.48 84.51 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 122.591 0.356 . . . . 0.0 110.707 175.56 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 48.2 mm -57.15 -44.49 83.42 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 CA-C-N 117.949 0.34 . . . . 0.0 110.701 177.007 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 1.3 tppm? -61.4 -39.87 92.3 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 123.529 0.732 . . . . 0.0 111.015 178.23 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 20.1 m -60.66 -42.07 96.27 Favored 'General case' 0 CA--C 1.533 0.302 0 O-C-N 121.732 -0.605 . . . . 0.0 111.187 175.301 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 43.2 mt -72.1 -40.37 66.67 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 C-N-CA 124.103 0.961 . . . . 0.0 111.44 -177.052 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 12.2 ptt180 -133.38 91.88 2.92 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 124.424 1.09 . . . . 0.0 108.244 174.477 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 17.5 p-10 -65.48 72.39 0.05 Allowed 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 125.946 1.699 . . . . 0.0 112.589 178.261 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 31.3 t70 . . . . . 0 C--O 1.251 1.163 0 C-N-CA 125.869 1.667 . . . . 0.0 108.072 176.431 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 0.619 0 CA-C-O 120.239 0.066 . . . . 0.0 110.887 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 30.0 m -85.63 -158.27 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.409 0 C-N-CA 124.078 0.951 . . . . 0.0 108.861 174.419 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -75.54 72.24 2.51 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 123.662 0.785 . . . . 0.0 110.574 178.427 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 25.1 mt-30 -95.81 -65.82 0.95 Allowed 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 124.627 1.171 . . . . 0.0 109.081 -179.066 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 55.0 m -100.31 -123.27 0.16 Allowed 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.835 1.254 . . . . 0.0 108.564 178.99 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -75.16 65.06 1.49 Allowed 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.853 1.261 . . . . 0.0 112.138 176.67 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 33.6 p-10 -18.99 -62.96 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 129.558 3.143 . . . . 0.0 117.22 -175.616 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 76.9 mtm -64.59 -48.08 76.27 Favored 'General case' 0 CA--C 1.529 0.152 0 C-N-CA 123.642 0.777 . . . . 0.0 110.791 -174.876 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 4.3 mp0 -64.88 -36.84 85.66 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 124.282 1.033 . . . . 0.0 110.022 176.498 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 44.3 tt0 -61.02 -64.98 0.77 Allowed 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 124.283 1.033 . . . . 0.0 110.503 -178.721 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 18.5 pt20 -59.41 -30.64 68.61 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 123.916 0.887 . . . . 0.0 111.789 -179.561 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 49.5 ttt-85 -66.1 -59.33 3.88 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.832 0.853 . . . . 0.0 110.999 177.278 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 22.8 mtp-105 -56.52 -38.15 71.42 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 124.748 1.219 . . . . 0.0 111.124 177.382 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 23.5 t80 -60.9 -53.46 56.98 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 125.61 1.564 . . . . 0.0 110.824 178.021 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 45.0 t80 -57.11 -49.12 76.88 Favored 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 123.806 0.842 . . . . 0.0 110.11 177.203 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 5.9 tm-20 -53.45 -57.21 11.46 Favored 'General case' 0 C--N 1.341 0.199 0 C-N-CA 123.549 0.74 . . . . 0.0 109.978 178.47 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -53.49 -55.66 23.5 Favored 'General case' 0 N--CA 1.456 -0.174 0 C-N-CA 124.052 0.941 . . . . 0.0 111.232 -178.084 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 63.3 tp -59.1 -54.65 44.6 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 124.462 1.105 . . . . 0.0 111.754 -176.467 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 21.3 m-70 -70.95 -37.78 72.84 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 122.956 0.502 . . . . 0.0 112.11 -173.532 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -67.86 120.63 75.17 Favored Pre-proline 0 CA--C 1.535 0.386 0 CA-C-O 118.957 -0.544 . . . . 0.0 110.737 -176.237 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 75.4 Cg_endo -80.62 -29.74 2.17 Favored 'Trans proline' 0 N--CA 1.455 -0.775 0 C-N-CA 123.39 2.727 . . . . 0.0 111.872 179.313 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 14.6 m120 -58.66 -34.79 71.61 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 125.062 1.345 . . . . 0.0 113.001 -170.803 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 85.6 mt -55.21 135.06 49.92 Favored 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 173.974 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 30.2 p-10 -83.59 48.08 1.37 Allowed 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 123.768 0.827 . . . . 0.0 112.683 -169.894 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 5.6 tm-20 70.81 -64.02 0.39 Allowed 'General case' 0 C--N 1.342 0.28 0 C-N-CA 126.071 1.748 . . . . 0.0 112.201 177.456 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 24.9 pt-20 -54.61 -44.88 73.49 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.89 0.876 . . . . 0.0 112.182 -174.893 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 45.1 mt-30 -64.24 -52.2 59.92 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 123.295 0.638 . . . . 0.0 110.671 178.296 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 26.5 ttp-105 -52.29 -47.85 65.66 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 124.765 1.226 . . . . 0.0 111.354 178.726 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 4.8 m-80 -70.98 -40.29 71.98 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 123.607 0.763 . . . . 0.0 111.379 -178.847 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.89 -45.49 92.33 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.251 0.62 . . . . 0.0 111.065 177.413 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 8.3 mmmm -56.1 -58.5 7.65 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 123.684 0.794 . . . . 0.0 109.44 174.013 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 50.8 mt -55.02 -53.43 34.14 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.275 0 C-N-CA 124.392 1.077 . . . . 0.0 112.209 -175.246 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.65 -43.03 97.96 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 118.557 0.617 . . . . 0.0 111.147 -176.553 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 30.4 t -58.41 -50.95 71.86 Favored 'General case' 0 C--N 1.342 0.263 0 C-N-CA 123.448 0.699 . . . . 0.0 110.211 178.071 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 48.5 mt -55.1 -48.49 76.02 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.189 0 C-N-CA 125.228 1.411 . . . . 0.0 110.894 177.86 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -60.09 -50.78 72.34 Favored 'General case' 0 N--CA 1.455 -0.181 0 CA-C-O 119.187 -0.435 . . . . 0.0 111.208 179.902 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -70.86 -24.54 62.53 Favored 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 113.297 0.851 . . . . 0.0 113.297 -177.979 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 32.7 t70 . . . . . 0 C--O 1.252 1.191 0 CA-C-O 117.052 -1.451 . . . . 0.0 109.946 -178.207 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.742 0 CA-C-O 120.687 0.279 . . . . 0.0 111.168 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 58.2 t -76.73 88.62 0.87 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 N-CA-C 108.364 -0.976 . . . . 0.0 108.364 179.757 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -74.74 -61.23 1.95 Allowed 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 123.997 0.919 . . . . 0.0 109.965 -179.724 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 1.7 pp0? -83.48 169.48 15.45 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 123.386 0.674 . . . . 0.0 110.825 177.042 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 87.4 p -136.93 43.17 2.4 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 124.508 1.123 . . . . 0.0 108.891 171.776 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 6.7 t80 -96.19 -46.77 6.32 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 125.082 1.353 . . . . 0.0 108.445 -179.784 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 39.9 t-20 -73.07 76.19 1.23 Allowed 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 124.563 1.145 . . . . 0.0 108.055 169.766 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 26.6 ttt -177.76 -55.08 0.01 OUTLIER 'General case' 0 N--CA 1.455 -0.208 0 C-N-CA 127.664 2.386 . . . . 0.0 105.031 -170.019 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 42.8 mt-30 -67.78 -52.13 40.77 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 105.895 -1.891 . . . . 0.0 105.895 169.198 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 95.4 mt-30 -82.04 82.93 7.45 Favored 'General case' 0 N--CA 1.448 -0.525 0 C-N-CA 125.301 1.44 . . . . 0.0 107.938 169.834 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 21.5 tp60 -116.44 -51.88 2.59 Favored 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 124.684 1.193 . . . . 0.0 108.514 174.129 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 13.8 tpt180 -65.31 -55.01 20.7 Favored 'General case' 0 C--N 1.34 0.189 0 C-N-CA 123.25 0.62 . . . . 0.0 109.84 174.032 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 81.5 mtp180 -52.66 -47.23 67.26 Favored 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 124.295 1.038 . . . . 0.0 110.521 178.382 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 8.7 t80 -61.48 -52.45 64.47 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 125.838 1.655 . . . . 0.0 112.095 179.362 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 91.1 t80 -58.26 -43.98 88.17 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 124.341 1.056 . . . . 0.0 110.631 178.54 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -63.78 -43.76 95.38 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.092 0.957 . . . . 0.0 110.849 177.92 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.49 -42.37 98.7 Favored 'General case' 0 C--N 1.341 0.225 0 C-N-CA 123.873 0.869 . . . . 0.0 111.188 176.766 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 58.4 tp -59.46 -51.59 69.23 Favored 'General case' 0 N--CA 1.454 -0.239 0 C-N-CA 123.414 0.685 . . . . 0.0 109.557 176.768 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 22.0 m-70 -93.84 49.52 1.35 Allowed 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 123.881 0.872 . . . . 0.0 110.774 -178.321 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -71.59 165.36 49.81 Favored Pre-proline 0 CA--C 1.539 0.543 0 CA-C-O 118.977 -0.535 . . . . 0.0 110.309 177.35 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -55.49 -65.82 0.1 Allowed 'Trans proline' 0 N--CA 1.457 -0.636 0 C-N-CA 123.148 2.565 . . . . 0.0 112.742 179.944 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 17.3 t-20 -167.73 70.32 0.09 Allowed 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 123.583 0.753 . . . . 0.0 109.762 -179.744 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -79.91 163.8 24.04 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 172.469 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 50.7 p-10 -79.87 17.87 0.89 Allowed 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 114.328 1.233 . . . . 0.0 114.328 -169.967 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 13.5 tp10 71.58 -44.92 0.6 Allowed 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 126.17 1.788 . . . . 0.0 113.187 -176.423 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 14.7 tp10 -57.22 -51.46 69.25 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 119.09 0.859 . . . . 0.0 110.638 178.072 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 45.7 mt-30 -62.15 -46.28 89.66 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 124.041 0.936 . . . . 0.0 111.151 178.883 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 45.9 ttm180 -55.42 -51.29 67.35 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 124.607 1.163 . . . . 0.0 110.402 178.455 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 47.6 t30 -61.5 -51.14 69.88 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 124.52 1.128 . . . . 0.0 110.396 179.54 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -54.51 -45.89 73.39 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 124.091 0.957 . . . . 0.0 111.743 -179.647 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 54.6 mmtt -55.62 -53.33 57.82 Favored 'General case' 0 C--N 1.34 0.169 0 C-N-CA 123.095 0.558 . . . . 0.0 110.214 173.06 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 89.9 mt -60.64 -35.21 62.19 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 C-N-CA 123.155 0.582 . . . . 0.0 111.866 -176.263 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 64.1 mttm -63.04 -48.41 78.81 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 119.162 0.892 . . . . 0.0 110.07 170.556 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 15.0 m -74.59 3.28 8.01 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 124.432 1.093 . . . . 0.0 113.459 -178.606 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 57.5 mt -107.85 -61.5 2.48 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.237 0 N-CA-C 106.867 -1.531 . . . . 0.0 106.867 171.543 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 19.7 tpp180 -81.4 68.96 7.93 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 125.187 1.395 . . . . 0.0 108.843 174.948 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -82.18 62.6 5.98 Favored 'General case' 0 CA--C 1.531 0.236 0 N-CA-C 108.501 -0.925 . . . . 0.0 108.501 174.814 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 11.6 t70 . . . . . 0 C--O 1.251 1.137 0 CA-C-O 117.184 -1.388 . . . . 0.0 110.37 -169.904 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.778 0 N-CA-C 111.74 0.274 . . . . 0.0 111.74 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 8.3 p -62.83 128.08 24.1 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.343 0 C-N-CA 123.77 0.828 . . . . 0.0 110.871 -177.718 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -81.7 67.44 7.68 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 124.438 1.095 . . . . 0.0 111.336 -174.412 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 87.7 mt-30 -71.86 -61.8 1.65 Allowed 'General case' 0 N--CA 1.456 -0.158 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 173.003 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 38.0 t -162.03 55.92 0.24 Allowed 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 124.152 0.981 . . . . 0.0 109.009 176.527 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 36.4 t80 -158.42 -58.15 0.07 Allowed 'General case' 0 C--N 1.34 0.152 0 C-N-CA 123.084 0.554 . . . . 0.0 110.957 178.308 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 21.0 m120 -78.68 63.61 3.49 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 123.97 0.908 . . . . 0.0 110.852 -173.84 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 26.7 ttt -169.83 -56.69 0.02 OUTLIER 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 126.959 2.104 . . . . 0.0 106.5 -175.144 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 22.0 mm100 -65.62 -38.95 90.87 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 123.93 0.892 . . . . 0.0 109.421 171.016 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 36.0 tt0 -49.58 -63.11 1.21 Allowed 'General case' 0 C--N 1.341 0.22 0 C-N-CA 124.848 1.259 . . . . 0.0 109.344 169.769 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 67.6 mt-30 -46.29 -33.8 4.02 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 125.861 1.664 . . . . 0.0 113.124 -169.957 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 44.8 mtt180 -56.34 -72.86 0.07 Allowed 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.446 1.098 . . . . 0.0 111.416 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -64.39 -38.38 90.82 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 124.284 1.033 . . . . 0.0 110.923 -178.743 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 49.2 t80 -59.43 -53.31 59.61 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 126.23 1.812 . . . . 0.0 110.966 -177.594 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 47.7 t80 -62.49 -45.04 94.82 Favored 'General case' 0 C--N 1.341 0.227 0 C-N-CA 123.562 0.745 . . . . 0.0 110.284 175.794 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 15.8 tp10 -55.74 -49.39 73.21 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 122.549 0.339 . . . . 0.0 110.866 -179.097 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.24 -51.46 68.85 Favored 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 123.8 0.84 . . . . 0.0 111.165 179.083 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 57.7 tp -60.65 -57.75 11.38 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 123.915 0.886 . . . . 0.0 111.2 -176.905 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 29.0 m-70 -83.41 61.81 6.39 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 124.738 1.215 . . . . 0.0 109.765 -178.659 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -158.6 120.27 1.93 Allowed Pre-proline 0 CA--C 1.533 0.326 0 C-N-CA 123.911 0.884 . . . . 0.0 109.061 177.69 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -77.9 -27.65 5.68 Favored 'Trans proline' 0 N--CA 1.455 -0.736 0 C-N-CA 123.316 2.677 . . . . 0.0 112.01 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -54.71 -53.68 51.8 Favored 'General case' 0 C--N 1.344 0.341 0 C-N-CA 123.711 0.804 . . . . 0.0 110.218 -179.335 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 81.1 mt -71.03 121.53 18.38 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 107.146 -1.428 . . . . 0.0 107.146 169.625 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 25.3 p30 -72.57 175.54 6.24 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-O 120.749 0.309 . . . . 0.0 110.742 -177.747 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -59.2 -51.39 70.18 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 123.186 0.594 . . . . 0.0 111.972 -171.729 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -62.77 -38.53 90.99 Favored 'General case' 0 CA--C 1.534 0.34 0 N-CA-C 111.867 0.321 . . . . 0.0 111.867 -179.551 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 85.5 mt-30 -62.28 -56.46 18.29 Favored 'General case' 0 C--N 1.34 0.163 0 C-N-CA 123.496 0.718 . . . . 0.0 110.823 178.523 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 31.6 ptt180 -66.29 -32.11 73.33 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 112.098 0.407 . . . . 0.0 112.098 -177.578 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 72.6 m-20 -64.93 -40.01 94.38 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 118.226 0.466 . . . . 0.0 110.864 172.224 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -63.38 -44.4 94.83 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 118.057 0.39 . . . . 0.0 110.669 175.953 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 11.9 mmmm -55.41 -51.49 66.69 Favored 'General case' 0 C--N 1.341 0.223 0 C-N-CA 123.237 0.615 . . . . 0.0 110.439 174.642 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 33.9 mt -51.74 -53.28 17.7 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.189 0 C-N-CA 123.404 0.682 . . . . 0.0 110.327 175.97 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 82.2 tttt -65.01 -25.84 68.03 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.039 0.535 . . . . 0.0 112.316 -177.359 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 49.5 m -74.34 -46.96 37.37 Favored 'General case' 0 CA--C 1.529 0.16 0 CA-C-N 118.691 0.678 . . . . 0.0 110.716 175.727 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 40.8 mt -63.72 -62.13 1.35 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.261 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 179.197 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 52.1 ttp85 -78.88 75.89 5.38 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 125.335 1.454 . . . . 0.0 107.72 170.09 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -61.68 76.3 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 127.336 2.254 . . . . 0.0 112.529 -178.129 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 19.2 t70 . . . . . 0 C--O 1.25 1.131 0 C-N-CA 125.5 1.52 . . . . 0.0 108.631 178.263 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.755 0 N-CA-C 111.643 0.238 . . . . 0.0 111.643 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 22.1 t -82.28 67.22 0.49 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 N-CA-C 108.25 -1.018 . . . . 0.0 108.25 179.664 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -84.6 86.61 7.29 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 124.357 1.063 . . . . 0.0 109.872 -175.86 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 36.6 mm-40 -77.07 71.69 3.58 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 123.711 0.804 . . . . 0.0 109.952 -179.892 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 40.8 p -158.49 53.19 0.43 Allowed 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 125.025 1.33 . . . . 0.0 108.113 -178.343 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 49.4 m-85 -80.22 76.24 7.0 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 124.085 0.954 . . . . 0.0 110.13 -173.438 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 24.8 t-20 -40.68 -54.04 2.67 Favored 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 126.332 1.853 . . . . 0.0 112.781 -178.723 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 97.4 mtp -60.47 -47.76 84.7 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 123.556 0.742 . . . . 0.0 111.566 -177.061 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 20.4 tt0 -57.9 -62.72 1.61 Allowed 'General case' 0 C--N 1.34 0.167 0 C-N-CA 123.8 0.84 . . . . 0.0 109.74 177.723 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.4 mp0 -48.42 -51.07 28.48 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 125.323 1.449 . . . . 0.0 111.314 -179.967 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 22.6 tt0 -54.33 -43.25 71.05 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 125.188 1.395 . . . . 0.0 111.635 176.473 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.48 -58.45 7.97 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 124.157 0.983 . . . . 0.0 109.488 177.226 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -61.39 -38.45 87.07 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-O 118.932 -0.556 . . . . 0.0 111.917 -178.933 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 25.1 m-85 -61.49 -43.79 98.24 Favored 'General case' 0 C--N 1.342 0.241 0 CA-C-N 118.999 0.818 . . . . 0.0 110.917 177.733 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 53.5 t80 -60.16 -46.74 88.64 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 118.082 0.401 . . . . 0.0 110.094 175.112 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 15.5 tp10 -56.38 -45.15 80.67 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 117.95 0.341 . . . . 0.0 110.876 177.934 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.15 -53.73 48.79 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 124.341 1.056 . . . . 0.0 111.336 -178.677 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 58.7 mt -61.95 -54.27 44.14 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 123.5 0.72 . . . . 0.0 110.575 -178.686 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 29.0 m-70 -85.1 66.21 9.63 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.265 1.026 . . . . 0.0 109.276 -177.82 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -127.46 140.34 37.72 Favored Pre-proline 0 CA--C 1.536 0.409 0 C-N-CA 125.743 1.617 . . . . 0.0 108.531 -178.544 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -76.89 -38.73 0.78 Allowed 'Trans proline' 0 N--CA 1.457 -0.636 0 C-N-CA 123.085 2.523 . . . . 0.0 112.841 -178.872 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 35.3 m120 -81.16 74.04 8.18 Favored 'General case' 0 C--N 1.34 0.185 0 C-N-CA 124.262 1.025 . . . . 0.0 110.498 -173.547 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 33.2 mt -98.86 140.14 33.48 Favored 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 112.937 0.717 . . . . 0.0 112.937 -174.762 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 52.1 p-10 -153.79 12.53 0.45 Allowed 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 126.561 1.944 . . . . 0.0 110.197 169.683 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 18.7 tp10 67.02 -47.5 0.47 Allowed 'General case' 0 C--N 1.346 0.449 0 C-N-CA 128.105 2.562 . . . . 0.0 113.177 -171.176 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 5.2 tm-20 -49.05 -45.21 42.52 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 124.789 1.235 . . . . 0.0 111.882 177.637 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 49.4 mm-40 -65.09 -41.54 94.88 Favored 'General case' 0 C--N 1.34 0.192 0 N-CA-C 109.902 -0.407 . . . . 0.0 109.902 -179.438 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 4.4 mmp_? -59.68 -61.85 2.31 Favored 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 177.492 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 17.4 t-20 -45.96 -50.18 15.04 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 126.128 1.771 . . . . 0.0 111.947 -177.878 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -55.7 -44.99 77.91 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 124.182 0.993 . . . . 0.0 111.595 176.259 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 26.1 mtpp -69.4 -42.08 75.56 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-O 118.432 -0.794 . . . . 0.0 111.777 179.635 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 10.3 mm -54.67 -53.97 27.13 Favored 'Isoleucine or valine' 0 C--N 1.345 0.377 0 CA-C-N 119.452 1.024 . . . . 0.0 110.144 -176.385 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 9.8 ptpp? -59.06 -41.41 87.85 Favored 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 111.889 0.329 . . . . 0.0 111.889 -178.579 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 37.6 m -60.49 -44.33 96.06 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 123.011 0.524 . . . . 0.0 111.117 177.559 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 63.1 mt -63.89 -42.55 96.18 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 C-N-CA 123.892 0.877 . . . . 0.0 110.24 179.109 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 34.3 mmt180 -58.89 -39.58 81.87 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 122.98 0.512 . . . . 0.0 110.65 175.608 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 65.9 m-20 -67.02 -53.66 29.17 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 122.738 0.415 . . . . 0.0 111.286 178.548 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 . . . . . 0 C--O 1.251 1.177 0 CA-C-O 117.517 -1.23 . . . . 0.0 110.487 -173.41 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.736 0 N-CA-C 111.734 0.272 . . . . 0.0 111.734 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 7.6 p -76.13 82.47 0.67 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.339 0 C-N-CA 123.692 0.797 . . . . 0.0 109.842 179.019 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -55.74 -41.34 73.77 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 124.155 0.982 . . . . 0.0 111.297 178.094 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 40.0 mt-30 -78.1 72.92 4.66 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 123.833 0.853 . . . . 0.0 110.17 177.945 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 86.1 p -147.0 -118.18 0.07 Allowed 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 124.044 0.937 . . . . 0.0 109.07 173.761 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 56.7 t80 -80.53 64.24 5.25 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 124.329 1.052 . . . . 0.0 109.664 -178.521 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 30.8 m120 -153.05 -65.26 0.15 Allowed 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 126.359 1.864 . . . . 0.0 106.874 -176.084 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 26.3 ptt? -58.95 -37.14 76.07 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 123.349 0.66 . . . . 0.0 110.321 172.428 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 40.3 mt-30 -54.36 -51.61 64.23 Favored 'General case' 0 C--N 1.341 0.235 0 C-N-CA 123.885 0.874 . . . . 0.0 110.064 171.401 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.3 tp-100 -58.64 -45.04 90.14 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 123.543 0.737 . . . . 0.0 110.905 -179.349 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 29.1 mm100 -60.86 -36.09 78.28 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-O 118.995 -0.526 . . . . 0.0 111.463 175.519 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.81 -39.46 83.98 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 118.473 0.579 . . . . 0.0 111.251 176.115 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 74.5 mtt85 -61.18 -46.71 89.38 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 118.42 0.554 . . . . 0.0 110.308 175.449 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 21.7 m-85 -61.14 -46.76 89.22 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 122.659 0.384 . . . . 0.0 111.261 175.855 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 52.8 t80 -54.81 -49.92 69.81 Favored 'General case' 0 C--O 1.225 -0.208 0 C-N-CA 124.034 0.933 . . . . 0.0 110.32 179.741 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -57.59 -52.81 63.9 Favored 'General case' 0 CA--C 1.531 0.229 0 N-CA-C 109.712 -0.477 . . . . 0.0 109.712 174.704 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -70.27 9.67 0.56 Allowed 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.885 1.274 . . . . 0.0 114.12 -179.987 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 64.6 tp -123.25 -37.48 2.69 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.457 1.103 . . . . 0.0 110.971 172.672 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 17.2 m-70 -90.95 -28.68 17.9 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.871 1.268 . . . . 0.0 113.464 -174.993 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -51.07 136.67 28.22 Favored Pre-proline 0 CA--C 1.543 0.687 0 C-N-CA 124.264 1.026 . . . . 0.0 112.297 -174.661 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_exo -45.53 -46.52 14.52 Favored 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 124.541 3.494 . . . . 0.0 115.777 -179.807 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 3.6 t30 -67.38 120.53 14.02 Favored 'General case' 0 C--N 1.34 0.172 0 N-CA-C 109.678 -0.49 . . . . 0.0 109.678 -177.699 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -156.04 130.28 8.76 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 122.86 0.464 . . . . 0.0 111.083 -173.911 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 1.8 p-10 -157.58 33.67 0.27 Allowed 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.11 0.964 . . . . 0.0 111.142 170.043 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.8 tm-20 72.33 -57.39 0.62 Allowed 'General case' 0 C--N 1.346 0.427 0 C-N-CA 127.054 2.142 . . . . 0.0 113.499 174.668 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 6.6 tm-20 -54.64 -49.53 70.34 Favored 'General case' 0 CA--C 1.529 0.158 0 C-N-CA 124.649 1.18 . . . . 0.0 110.416 -177.081 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 13.4 mm100 -56.27 -49.88 72.94 Favored 'General case' 0 C--N 1.341 0.233 0 C-N-CA 123.259 0.623 . . . . 0.0 109.764 -178.231 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 5.3 mpt_? -51.44 -73.82 0.04 OUTLIER 'General case' 0 CA--C 1.515 -0.385 0 C-N-CA 125.12 1.368 . . . . 0.0 110.745 178.023 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 18.3 m-80 -54.24 -38.15 65.42 Favored 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 111.914 0.339 . . . . 0.0 111.914 -170.787 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -61.16 -58.14 9.58 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 123.071 0.549 . . . . 0.0 111.812 175.933 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 14.8 ptpt -67.83 -44.23 77.72 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 118.008 0.367 . . . . 0.0 111.132 -174.679 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 6.3 mm -48.05 -52.04 8.01 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.16 0 C-N-CA 125.686 1.595 . . . . 0.0 109.962 174.148 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 23.0 ttmm -60.91 -48.95 79.44 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 123.804 0.842 . . . . 0.0 111.248 -178.763 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 83.7 p -62.79 -40.88 98.69 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 122.553 0.341 . . . . 0.0 111.849 -178.176 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 61.3 mt -63.3 -44.13 98.98 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.321 0 C-N-CA 124.075 0.95 . . . . 0.0 109.057 175.021 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 33.2 ttm180 -80.88 55.01 2.31 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 125.176 1.391 . . . . 0.0 110.478 179.447 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -109.23 -51.35 2.89 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 125.58 1.552 . . . . 0.0 108.666 175.341 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 29.8 t70 . . . . . 0 C--O 1.25 1.106 0 CA-C-O 117.365 -1.303 . . . . 0.0 108.063 176.952 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 0.65 0 CA-C-O 119.17 -0.443 . . . . 0.0 110.851 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 14.6 m 40.83 -116.7 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 C-N-CA 126.105 1.762 . . . . 0.0 112.572 177.608 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -57.78 -33.13 68.2 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 125.03 1.332 . . . . 0.0 113.539 -179.385 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 6.6 tm0? 70.38 -69.06 0.18 Allowed 'General case' 0 C--N 1.342 0.255 0 C-N-CA 126.531 1.932 . . . . 0.0 110.875 -175.891 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 7.8 m -66.41 -7.04 16.72 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 124.882 1.273 . . . . 0.0 114.211 -169.997 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 36.3 p90 -146.19 30.96 1.02 Allowed 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 124.2 1.0 . . . . 0.0 110.845 169.937 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -132.92 -68.48 0.59 Allowed 'General case' 0 C--N 1.338 0.102 0 C-N-CA 125.16 1.384 . . . . 0.0 108.926 175.059 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 96.1 mmm -68.37 -33.98 75.25 Favored 'General case' 0 N--CA 1.456 -0.142 0 C-N-CA 123.623 0.769 . . . . 0.0 110.099 176.339 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 21.3 tt0 -54.49 -62.46 1.64 Allowed 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 169.92 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 72.7 mt-30 -60.64 -35.06 75.25 Favored 'General case' 0 C--N 1.34 0.153 0 C-N-CA 124.101 0.96 . . . . 0.0 111.97 -175.1 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -52.72 -48.97 66.3 Favored 'General case' 0 N--CA 1.456 -0.17 0 C-N-CA 123.058 0.543 . . . . 0.0 109.666 171.582 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 16.2 mmm-85 -67.91 -34.28 76.32 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-O 118.47 -0.776 . . . . 0.0 112.88 175.907 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 28.4 mmt85 -56.58 -51.7 67.64 Favored 'General case' 0 C--N 1.341 0.236 0 CA-C-N 119.175 0.898 . . . . 0.0 109.705 175.166 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 11.0 m-85 -56.47 -52.19 65.62 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 123.814 0.845 . . . . 0.0 110.918 173.419 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 31.6 t80 -78.97 60.91 3.03 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.485 1.114 . . . . 0.0 109.883 -179.529 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 178.94 -55.03 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 127.339 2.256 . . . . 0.0 107.362 -174.724 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.37 -44.99 96.23 Favored 'General case' 0 C--N 1.34 0.181 0 C-N-CA 124.899 1.279 . . . . 0.0 110.565 175.232 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 89.4 mt -58.33 -47.43 83.76 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 123.118 0.567 . . . . 0.0 109.844 172.343 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 22.5 m-70 -86.37 54.96 3.34 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 124.412 1.085 . . . . 0.0 110.331 -176.535 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 10.6 t0 -124.99 85.18 58.14 Favored Pre-proline 0 CA--C 1.535 0.373 0 C-N-CA 124.425 1.09 . . . . 0.0 109.382 -175.93 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -82.14 59.4 7.02 Favored 'Trans proline' 0 N--CA 1.456 -0.71 0 C-N-CA 123.856 3.037 . . . . 0.0 109.887 179.626 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -155.72 -58.62 0.1 Allowed 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 124.586 1.154 . . . . 0.0 108.981 179.286 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 91.2 mt -70.78 144.16 50.96 Favored 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 174.699 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 29.8 p-10 -79.51 174.66 11.35 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-O 121.195 0.521 . . . . 0.0 110.867 179.943 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 35.8 tp10 -60.88 -36.75 80.02 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 123.772 0.829 . . . . 0.0 111.592 -176.995 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 51.9 mt-10 -59.76 -57.51 12.59 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 123.322 0.649 . . . . 0.0 110.735 179.728 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 37.3 mt-30 -59.59 -47.76 84.31 Favored 'General case' 0 CA--C 1.529 0.148 0 C-N-CA 124.042 0.937 . . . . 0.0 110.787 -178.995 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 12.1 ttp-105 -52.83 -55.13 25.28 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 124.716 1.206 . . . . 0.0 111.046 176.972 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 6.5 m120 -59.95 -44.91 94.11 Favored 'General case' 0 CA--C 1.529 0.156 0 C-N-CA 122.693 0.397 . . . . 0.0 110.858 179.324 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.19 -51.08 69.34 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 123.991 0.916 . . . . 0.0 111.744 -177.768 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 19.7 ptpt -65.09 -41.41 95.02 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 118.113 0.415 . . . . 0.0 111.302 179.499 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 5.7 mt -60.39 -52.27 63.33 Favored 'Isoleucine or valine' 0 C--N 1.34 0.171 0 CA-C-O 118.755 -0.64 . . . . 0.0 111.176 -179.452 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 15.0 ptmm? -62.09 -37.67 85.95 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 118.856 0.753 . . . . 0.0 111.591 -178.783 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 55.7 m -61.24 -50.51 72.76 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 122.9 0.48 . . . . 0.0 111.014 177.531 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 89.3 mt -60.88 -51.71 70.02 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 C-N-CA 123.89 0.876 . . . . 0.0 110.195 179.194 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 37.7 ttm180 -60.24 -36.29 77.42 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 124.846 1.258 . . . . 0.0 111.624 -177.172 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -74.45 80.68 1.92 Allowed 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 123.729 0.812 . . . . 0.0 109.293 173.391 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 . . . . . 0 C--O 1.251 1.144 0 C-N-CA 126.591 1.957 . . . . 0.0 110.658 178.27 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.74 0 N-CA-C 111.639 0.237 . . . . 0.0 111.639 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 87.3 t -70.11 109.16 2.54 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.205 0 N-CA-C 108.979 -0.749 . . . . 0.0 108.979 179.937 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -79.44 -88.02 0.06 Allowed 'General case' 0 CA--C 1.531 0.238 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 176.789 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 65.6 mm-40 47.19 57.61 5.6 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 125.497 1.519 . . . . 0.0 111.606 177.906 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 18.2 t -91.16 -147.95 0.21 Allowed 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.711 1.204 . . . . 0.0 109.195 -177.486 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 4.1 t80 -68.84 96.54 0.76 Allowed 'General case' 0 N--CA 1.446 -0.652 0 N-CA-C 106.843 -1.54 . . . . 0.0 106.843 170.715 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 51.2 t30 -38.39 -54.4 1.46 Allowed 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 125.999 1.719 . . . . 0.0 112.66 -179.716 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 13.5 tpt -81.9 64.49 6.62 Favored 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 123.421 0.688 . . . . 0.0 109.963 178.577 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 3.4 tm0? 176.42 -48.21 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 128.273 2.629 . . . . 0.0 106.786 -177.586 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 63.6 tt0 -57.27 -49.51 75.85 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 125.242 1.417 . . . . 0.0 109.468 172.619 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -57.75 -38.06 74.73 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.868 1.267 . . . . 0.0 111.617 174.487 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 40.6 tpt85 -67.65 -51.81 45.55 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 123.715 0.806 . . . . 0.0 110.631 -178.768 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 78.2 ttt-85 -57.74 -51.71 68.44 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 125.586 1.554 . . . . 0.0 110.645 176.793 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 13.1 t80 -47.14 -59.74 2.94 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 126.243 1.817 . . . . 0.0 111.513 173.508 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 50.9 t80 -56.09 -49.18 74.56 Favored 'General case' 0 N--CA 1.456 -0.141 0 C-N-CA 124.128 0.971 . . . . 0.0 110.843 -179.42 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -56.77 -54.52 45.31 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 123.442 0.697 . . . . 0.0 110.748 -177.822 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.21 -44.52 97.15 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 123.658 0.783 . . . . 0.0 111.944 -178.349 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 59.8 tp -61.36 -53.2 59.75 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 124.23 1.012 . . . . 0.0 110.993 -179.621 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 19.4 m-70 -76.62 -50.98 12.46 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 123.593 0.757 . . . . 0.0 111.951 -173.694 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 9.5 t0 -67.23 124.29 88.6 Favored Pre-proline 0 CA--C 1.535 0.389 0 CA-C-O 118.87 -0.586 . . . . 0.0 109.668 -174.84 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_endo -76.15 -10.03 19.3 Favored 'Trans proline' 0 N--CA 1.456 -0.707 0 C-N-CA 123.412 2.741 . . . . 0.0 114.355 -171.937 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -62.56 -31.84 72.7 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 114.382 1.253 . . . . 0.0 114.382 -169.981 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 10.6 mp -63.67 146.63 53.44 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 118.555 0.616 . . . . 0.0 110.073 177.153 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 44.0 p-10 -84.62 29.35 0.61 Allowed 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 114.451 1.278 . . . . 0.0 114.451 -169.71 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 76.34 -58.37 0.53 Allowed 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 124.852 1.261 . . . . 0.0 111.384 -174.878 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 5.6 mp0 -56.88 -49.95 73.98 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 123.385 0.674 . . . . 0.0 110.663 -178.732 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 59.7 mt-30 -51.61 -60.0 3.65 Favored 'General case' 0 C--N 1.34 0.17 0 C-N-CA 124.44 1.096 . . . . 0.0 111.084 178.423 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 10.7 ptp85 -63.42 -44.97 93.08 Favored 'General case' 0 C--N 1.342 0.251 0 CA-C-O 119.253 -0.403 . . . . 0.0 110.75 -175.883 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -55.23 -51.86 65.23 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 123.748 0.819 . . . . 0.0 111.094 -178.132 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -53.78 -53.52 51.15 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 123.641 0.777 . . . . 0.0 111.485 -178.475 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 19.9 ptpt -69.8 -36.94 76.08 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-O 118.648 -0.691 . . . . 0.0 112.007 -178.704 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 44.4 mt -59.44 -45.3 93.73 Favored 'Isoleucine or valine' 0 C--N 1.34 0.189 0 CA-C-N 119.1 0.864 . . . . 0.0 110.162 178.855 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 44.2 mmtm -59.29 -43.27 92.57 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 122.49 0.316 . . . . 0.0 110.496 175.639 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 16.0 m -63.75 -42.21 97.89 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.281 0.632 . . . . 0.0 111.714 179.104 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 30.5 mt -61.56 -49.41 84.51 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.195 0 C-N-CA 125.128 1.371 . . . . 0.0 109.228 176.884 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -82.87 51.47 1.92 Allowed 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 124.714 1.206 . . . . 0.0 110.57 -179.679 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 3.9 p30 -81.99 -36.19 28.14 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 123.299 0.64 . . . . 0.0 109.792 171.431 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 10.0 p-10 . . . . . 0 C--O 1.252 1.191 0 C-N-CA 124.908 1.283 . . . . 0.0 110.459 176.632 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.75 0 CA-C-O 120.706 0.288 . . . . 0.0 111.189 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 24.7 t -80.37 76.03 0.85 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 -179.388 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -64.52 -41.57 96.3 Favored 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 123.926 0.89 . . . . 0.0 110.838 178.527 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 7.0 pt20 -139.05 178.25 7.3 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 124.91 1.284 . . . . 0.0 109.489 177.095 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 53.0 m -76.4 102.38 5.94 Favored 'General case' 0 N--CA 1.448 -0.555 0 N-CA-C 106.133 -1.802 . . . . 0.0 106.133 169.681 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 62.2 m-85 -79.24 66.61 4.74 Favored 'General case' 0 N--CA 1.457 -0.115 0 CA-C-O 121.721 0.772 . . . . 0.0 109.645 179.498 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 29.6 m-80 -136.14 -49.39 0.68 Allowed 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 126.505 1.922 . . . . 0.0 108.019 -177.936 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 25.4 ptt? -63.9 -40.62 96.93 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 122.826 0.45 . . . . 0.0 110.498 171.05 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 31.5 tt0 -61.22 -48.18 82.69 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 123.086 0.555 . . . . 0.0 110.05 175.205 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 21.4 tt0 -55.47 -51.69 66.11 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 123.826 0.85 . . . . 0.0 110.221 177.705 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 20.1 tt0 -53.81 -37.02 63.11 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 125.286 1.434 . . . . 0.0 111.508 176.47 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 13.4 mmp_? -70.78 -51.29 27.92 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 118.883 0.765 . . . . 0.0 111.64 178.832 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.42 -50.38 67.73 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 118.897 0.772 . . . . 0.0 109.996 176.973 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 78.1 t80 -50.32 -55.88 13.63 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 126.941 2.096 . . . . 0.0 112.081 174.172 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 49.4 t80 -58.82 -48.66 80.52 Favored 'General case' 0 C--N 1.339 0.14 0 C-N-CA 124.6 1.16 . . . . 0.0 110.927 -178.298 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -54.91 -54.67 39.64 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 123.494 0.717 . . . . 0.0 109.806 178.985 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -56.68 -49.08 76.16 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 122.616 0.366 . . . . 0.0 111.904 -179.671 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 54.4 tp -58.43 -53.67 55.68 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 124.084 0.954 . . . . 0.0 111.333 -178.837 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 19.4 m-70 -77.39 -45.77 24.86 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.783 0.833 . . . . 0.0 112.648 -171.489 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 80.0 m-20 -62.9 130.7 94.19 Favored Pre-proline 0 CA--C 1.537 0.456 0 CA-C-N 118.215 0.462 . . . . 0.0 110.647 -171.254 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -70.77 -29.28 19.3 Favored 'Trans proline' 0 N--CA 1.457 -0.634 0 C-N-CA 123.973 3.115 . . . . 0.0 113.562 -169.755 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 9.8 p-10 -58.76 -27.99 65.48 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 118.493 0.588 . . . . 0.0 111.796 -179.863 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -84.08 72.13 10.5 Favored 'General case' 0 C--N 1.342 0.273 0 N-CA-C 106.112 -1.81 . . . . 0.0 106.112 169.442 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 -77.29 58.09 1.58 Allowed 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 125.612 1.565 . . . . 0.0 112.687 -169.997 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 22.6 tt0 70.76 157.59 0.17 Allowed 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 125.239 1.416 . . . . 0.0 110.63 -176.919 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.3 tp10 73.8 -56.13 0.65 Allowed 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 127.027 2.131 . . . . 0.0 110.811 -175.392 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 50.9 mt-30 -54.86 -61.59 2.21 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 125.31 1.444 . . . . 0.0 110.01 175.632 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 19.4 ptt180 -63.23 -38.88 92.92 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 123.599 0.76 . . . . 0.0 111.76 178.861 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 14.4 m120 -61.0 -45.02 96.5 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 118.387 0.539 . . . . 0.0 111.099 179.924 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -60.12 -47.54 85.48 Favored 'General case' 0 CA--C 1.529 0.165 0 C-N-CA 123.564 0.745 . . . . 0.0 110.439 176.639 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 30.6 tttt -55.32 -51.17 67.59 Favored 'General case' 0 N--CA 1.448 -0.541 0 C-N-CA 123.441 0.697 . . . . 0.0 111.396 175.748 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 58.2 mt -58.39 -44.73 89.2 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.205 0 C-N-CA 124.269 1.028 . . . . 0.0 110.293 -179.361 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 27.2 ttpp -58.77 -46.95 86.32 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 123.488 0.715 . . . . 0.0 111.251 177.071 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 88.9 p -68.22 -37.87 81.3 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 118.438 0.563 . . . . 0.0 111.94 -179.705 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 68.8 mt -64.82 -60.7 2.34 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.188 0 C-N-CA 123.907 0.883 . . . . 0.0 110.149 179.238 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 17.7 ptp180 -133.66 70.38 1.46 Allowed 'General case' 0 N--CA 1.456 -0.133 0 C-N-CA 123.99 0.916 . . . . 0.0 109.734 -173.215 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -53.26 -48.83 67.94 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 124.363 1.065 . . . . 0.0 111.556 177.968 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 38.2 t70 . . . . . 0 C--O 1.25 1.092 0 CA-C-O 116.536 -1.697 . . . . 0.0 110.724 179.125 . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.733 0 N-CA-C 111.484 0.179 . . . . 0.0 111.484 . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 34.4 m -61.07 -22.65 27.64 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.23 0 C-N-CA 123.904 0.882 . . . . 0.0 112.967 -179.532 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -55.4 -46.44 76.59 Favored 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 124.655 1.182 . . . . 0.0 110.574 174.141 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 8.8 tp-100 -68.89 97.56 0.85 Allowed 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 175.022 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 42.5 m -102.03 57.41 0.81 Allowed 'General case' 0 N--CA 1.448 -0.557 0 C-N-CA 125.515 1.526 . . . . 0.0 107.595 -175.766 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 44.1 p90 -53.31 -25.39 14.69 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 124.777 1.231 . . . . 0.0 111.365 177.026 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 5.3 p-10 -53.63 -32.1 49.96 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 124.354 1.062 . . . . 0.0 112.29 178.286 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 95.0 mmm -63.65 -51.56 64.59 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 123.258 0.623 . . . . 0.0 110.936 -179.807 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -67.22 -38.46 85.28 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-O 119.236 -0.412 . . . . 0.0 110.649 176.105 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -82.93 51.1 1.85 Allowed 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.227 1.411 . . . . 0.0 109.969 176.272 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? -165.17 -52.78 0.03 OUTLIER 'General case' 0 CA--C 1.523 -0.075 0 C-N-CA 126.777 2.031 . . . . 0.0 106.465 -178.947 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 6.1 tmm_? -50.78 -48.56 59.35 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 125.435 1.494 . . . . 0.0 109.874 171.961 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 19.2 ptp180 -63.87 -45.24 90.34 Favored 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 112.582 0.586 . . . . 0.0 112.582 -179.01 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 60.8 m-85 -64.11 -47.42 80.07 Favored 'General case' 0 C--N 1.339 0.139 0 C-N-CA 122.66 0.384 . . . . 0.0 110.386 -179.66 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 64.1 t80 -56.64 -46.82 80.77 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 123.902 0.881 . . . . 0.0 110.495 175.236 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 12.9 tp10 -58.77 -58.47 8.46 Favored 'General case' 0 N--CA 1.455 -0.225 0 C-N-CA 122.949 0.5 . . . . 0.0 110.027 -179.228 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -52.93 -47.24 68.17 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 124.648 1.179 . . . . 0.0 111.588 -179.982 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 63.7 tp -60.14 -49.93 75.69 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.095 0.958 . . . . 0.0 110.612 178.221 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 17.1 m-70 -85.46 54.76 3.23 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.135 0.974 . . . . 0.0 110.453 -178.996 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 73.7 m-20 -135.29 83.49 38.16 Favored Pre-proline 0 CA--C 1.532 0.288 0 C-N-CA 124.698 1.199 . . . . 0.0 108.68 171.482 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_exo -51.99 -42.93 55.72 Favored 'Trans proline' 0 N--CA 1.459 -0.517 0 C-N-CA 124.118 3.212 . . . . 0.0 113.167 175.721 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 50.3 t30 -55.29 -46.66 76.2 Favored 'General case' 0 C--N 1.341 0.21 0 C-N-CA 124.6 1.16 . . . . 0.0 111.651 -178.611 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -73.04 108.81 6.14 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 106.734 -1.58 . . . . 0.0 106.734 173.346 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 1.9 p30 -64.79 170.14 4.47 Favored 'General case' 0 CA--C 1.531 0.218 0 N-CA-C 111.538 0.199 . . . . 0.0 111.538 -172.389 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -47.05 -41.73 17.27 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 124.659 1.184 . . . . 0.0 112.683 -177.093 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 14.3 tp10 -60.83 -58.47 8.31 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 118.354 0.525 . . . . 0.0 110.976 179.503 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 71.9 mt-30 -58.15 -50.55 73.11 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 124.211 1.004 . . . . 0.0 110.806 -178.507 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 17.9 ttp180 -56.83 -55.17 37.83 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 125.594 1.558 . . . . 0.0 110.999 -179.813 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 -60.04 -42.2 93.92 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 122.806 0.443 . . . . 0.0 111.109 179.474 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.96 -43.34 91.27 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 123.196 0.599 . . . . 0.0 111.167 177.509 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 25.8 mmtp -58.5 -58.46 8.42 Favored 'General case' 0 C--N 1.341 0.229 0 C-N-CA 122.875 0.47 . . . . 0.0 110.181 174.883 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 30.3 mm -48.87 -51.77 11.32 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 C-N-CA 123.623 0.769 . . . . 0.0 110.724 -179.522 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 66.0 tttp -61.41 -54.85 38.21 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 124.303 1.041 . . . . 0.0 111.221 -178.168 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 85.6 p -59.3 -38.67 80.81 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 123.261 0.625 . . . . 0.0 112.141 -175.593 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 71.6 mt -61.04 -55.07 27.19 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 C-N-CA 123.578 0.751 . . . . 0.0 110.442 -179.502 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 19.5 ptp180 -72.05 -49.51 36.08 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 118.155 0.434 . . . . 0.0 111.447 -178.225 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -92.87 67.75 4.43 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 124.697 1.199 . . . . 0.0 108.631 177.979 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 8.8 p-10 . . . . . 0 C--O 1.251 1.142 0 CA-C-O 116.857 -1.544 . . . . 0.0 110.394 178.033 . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 0.649 0 CA-C-O 120.082 -0.009 . . . . 0.0 110.993 . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 19.6 m -147.2 149.38 15.68 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.235 0 C-N-CA 125.084 1.354 . . . . 0.0 109.025 176.482 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -158.68 79.48 0.79 Allowed 'General case' 0 N--CA 1.456 -0.142 0 N-CA-C 107.982 -1.118 . . . . 0.0 107.982 176.261 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 5.6 pt20 -147.79 52.23 1.04 Allowed 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 124.326 1.05 . . . . 0.0 109.757 -174.102 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 67.1 m -82.71 -96.63 0.05 Allowed 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 124.102 0.961 . . . . 0.0 109.96 -179.008 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -84.94 69.04 10.74 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 124.386 1.074 . . . . 0.0 108.205 177.703 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 53.0 m-80 -49.0 -50.18 37.13 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 125.59 1.556 . . . . 0.0 113.282 -170.309 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 25.2 ptp -63.83 -29.61 70.79 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 112.861 0.689 . . . . 0.0 112.861 -177.317 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 42.5 tt0 -79.6 -44.01 21.83 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 123.388 0.675 . . . . 0.0 109.788 176.615 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 20.3 tt0 -56.6 -41.58 77.26 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.532 1.133 . . . . 0.0 110.775 176.795 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 18.4 tt0 -54.4 -29.76 50.03 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 126.204 1.801 . . . . 0.0 112.021 175.042 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 21.0 mmt85 -70.71 -57.54 4.57 Favored 'General case' 0 C--N 1.341 0.2 0 CA-C-N 118.972 0.806 . . . . 0.0 109.397 177.668 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 79.7 mtt85 -50.58 -47.67 57.86 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 124.215 1.006 . . . . 0.0 110.632 177.76 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 31.2 t80 -48.68 -51.35 28.97 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 126.423 1.889 . . . . 0.0 111.287 173.891 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 18.2 m-30 -68.0 -35.67 78.72 Favored 'General case' 0 C--O 1.225 -0.218 0 C-N-CA 123.233 0.613 . . . . 0.0 111.649 179.142 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -60.55 -25.23 66.0 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 119.803 1.183 . . . . 0.0 111.64 175.813 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -84.45 -49.79 8.34 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 123.234 0.614 . . . . 0.0 111.497 171.727 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 34.4 tp -82.42 -57.47 3.34 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.065 0.946 . . . . 0.0 111.413 -170.295 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 25.0 m170 -77.68 69.63 3.95 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 125.404 1.482 . . . . 0.0 108.778 177.727 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -158.45 158.38 29.56 Favored Pre-proline 0 CA--C 1.534 0.333 0 C-N-CA 124.666 1.186 . . . . 0.0 107.866 -172.157 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -67.5 42.2 0.21 Allowed 'Trans proline' 0 CA--C 1.544 1.01 0 C-N-CA 123.737 2.958 . . . . 0.0 114.219 169.767 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 14.9 t-20 61.16 92.89 0.05 OUTLIER 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 126.955 2.102 . . . . 0.0 112.578 177.777 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 78.2 mt -64.51 162.32 15.59 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 169.729 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 10.0 p30 -54.63 144.41 21.87 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 123.088 0.555 . . . . 0.0 110.646 178.182 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 15.3 mp0 -52.45 -42.18 63.94 Favored 'General case' 0 C--O 1.226 -0.143 0 C-N-CA 124.411 1.084 . . . . 0.0 112.013 -173.932 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.4 tm-20 -56.43 -61.73 2.21 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 122.915 0.486 . . . . 0.0 110.551 -177.757 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 79.5 mm-40 -61.2 -51.95 66.86 Favored 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 123.135 0.574 . . . . 0.0 110.916 179.197 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 32.2 ttp-105 -57.19 -61.98 2.08 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 123.693 0.797 . . . . 0.0 110.706 -174.142 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 14.4 t-20 -59.39 -39.7 84.19 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 123.974 0.91 . . . . 0.0 111.174 -175.548 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -57.15 -51.27 70.0 Favored 'General case' 0 C--N 1.342 0.257 0 C-N-CA 122.695 0.398 . . . . 0.0 110.83 176.447 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 59.8 mtpt -59.3 -54.84 42.16 Favored 'General case' 0 C--N 1.341 0.238 0 C-N-CA 123.081 0.552 . . . . 0.0 110.59 177.381 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 14.6 mm -51.14 -49.73 28.0 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.276 0 C-N-CA 124.207 1.003 . . . . 0.0 110.682 -178.384 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 27.7 tptp -73.07 -42.21 63.3 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 123.216 0.606 . . . . 0.0 111.973 -175.445 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 99.1 p -61.97 -34.39 76.05 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 118.647 0.658 . . . . 0.0 111.015 178.873 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 90.7 mt -73.11 -49.47 38.28 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.255 0 C-N-CA 124.518 1.127 . . . . 0.0 109.596 175.682 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 81.5 mtp180 -89.77 61.78 5.52 Favored 'General case' 0 CA--C 1.529 0.165 0 C-N-CA 124.228 1.011 . . . . 0.0 108.822 176.542 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 30.2 t0 -77.75 83.32 4.11 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 123.817 0.847 . . . . 0.0 109.387 -176.318 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 33.3 t70 . . . . . 0 C--O 1.25 1.106 0 C-N-CA 125.398 1.479 . . . . 0.0 108.698 175.509 . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 0.72 0 N-CA-C 111.651 0.241 . . . . 0.0 111.651 . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 16.4 t 59.13 76.27 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.28 0 C-N-CA 125.251 1.42 . . . . 0.0 110.002 -179.561 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -64.72 130.14 42.43 Favored 'General case' 0 N--CA 1.456 -0.169 0 N-CA-C 109.496 -0.557 . . . . 0.0 109.496 176.868 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 29.3 mm100 -81.81 40.8 0.62 Allowed 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 124.093 0.957 . . . . 0.0 111.715 -175.333 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 21.5 m -59.55 -34.24 72.42 Favored 'General case' 0 N--CA 1.456 -0.171 0 C-N-CA 124.185 0.994 . . . . 0.0 111.531 177.806 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 48.3 p90 -74.6 28.68 0.08 Allowed 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.733 1.613 . . . . 0.0 113.386 -178.816 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 13.2 m-80 -144.43 -53.89 0.33 Allowed 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 125.178 1.391 . . . . 0.0 109.416 -177.783 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -102.03 -33.83 9.57 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 123.938 0.895 . . . . 0.0 113.222 -173.638 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 27.6 mm100 -76.12 -57.3 3.95 Favored 'General case' 0 C--N 1.343 0.296 0 CA-C-N 119.712 1.142 . . . . 0.0 107.946 169.858 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 20.2 mt-30 -82.47 106.34 14.25 Favored 'General case' 0 N--CA 1.449 -0.504 0 N-CA-C 107.394 -1.336 . . . . 0.0 107.394 178.476 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 17.8 tp60 -149.51 -51.21 0.15 Allowed 'General case' 0 CA--C 1.532 0.25 0 CA-C-O 118.923 -0.561 . . . . 0.0 111.834 -176.663 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -70.11 -79.59 0.06 Allowed 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 118.851 0.751 . . . . 0.0 110.557 -172.874 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -55.88 -26.2 46.01 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 124.522 1.129 . . . . 0.0 112.243 173.688 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 62.2 t80 -67.75 -49.43 62.57 Favored 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 125.202 1.401 . . . . 0.0 110.973 178.94 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 70.4 t80 -58.08 -41.15 82.82 Favored 'General case' 0 C--N 1.34 0.19 0 CA-C-O 119.194 -0.431 . . . . 0.0 110.128 174.31 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 15.3 tp10 -59.23 -57.97 10.67 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 118.356 0.525 . . . . 0.0 110.042 176.68 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -52.68 -46.46 67.27 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 124.672 1.189 . . . . 0.0 112.359 -178.245 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 73.0 mt -62.75 -62.14 1.93 Allowed 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.211 0.604 . . . . 0.0 109.775 175.776 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 19.6 m-70 -84.97 48.82 1.62 Allowed 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.53 1.132 . . . . 0.0 110.711 -177.095 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -77.73 162.13 69.16 Favored Pre-proline 0 CA--C 1.538 0.488 0 N-CA-C 108.394 -0.965 . . . . 0.0 108.394 173.711 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -79.13 65.2 8.88 Favored 'Trans proline' 0 N--CA 1.454 -0.842 0 C-N-CA 124.243 3.295 . . . . 0.0 109.861 179.704 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 31.0 m120 59.25 67.78 0.87 Allowed 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 126.792 2.037 . . . . 0.0 112.768 169.97 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 82.0 mt -67.92 166.42 15.71 Favored 'General case' 0 CA--C 1.532 0.283 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 169.72 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 48.7 p-10 -75.9 26.35 0.11 Allowed 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.851 1.26 . . . . 0.0 113.91 -174.54 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 73.01 -55.61 0.68 Allowed 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 126.03 1.732 . . . . 0.0 111.689 -174.954 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -53.83 -54.53 37.12 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 125.094 1.358 . . . . 0.0 111.303 -177.567 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 42.7 mt-30 -61.22 -45.31 95.09 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 123.686 0.794 . . . . 0.0 111.128 -178.813 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 37.6 ttm105 -56.98 -55.85 29.32 Favored 'General case' 0 C--N 1.34 0.196 0 C-N-CA 122.845 0.458 . . . . 0.0 110.118 177.394 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 47.9 m-20 -54.35 -45.19 72.68 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 123.994 0.918 . . . . 0.0 111.052 -179.865 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.43 -43.97 88.94 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 123.351 0.66 . . . . 0.0 111.302 177.165 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 61.2 mtpt -62.06 -45.15 94.79 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-O 119.079 -0.486 . . . . 0.0 110.91 176.986 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 45.2 mm -57.98 -47.34 86.85 Favored 'Isoleucine or valine' 0 C--N 1.342 0.259 0 CA-C-N 118.851 0.751 . . . . 0.0 110.328 176.183 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 63.0 mttp -58.75 -39.16 80.13 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 123.035 0.534 . . . . 0.0 111.563 177.52 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 40.4 m -63.72 -46.42 85.5 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 122.853 0.461 . . . . 0.0 110.946 177.189 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 74.1 mt -63.14 -42.16 95.52 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 C-N-CA 123.567 0.747 . . . . 0.0 110.2 178.892 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 1.5 mmp_? -59.33 -52.24 66.49 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 124.043 0.937 . . . . 0.0 110.035 176.611 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -82.97 70.54 9.99 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 124.361 1.064 . . . . 0.0 109.595 179.535 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 32.9 t70 . . . . . 0 C--O 1.252 1.197 0 CA-C-O 117.184 -1.388 . . . . 0.0 109.257 -179.671 . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 0.684 0 CA-C-O 120.771 0.32 . . . . 0.0 111.154 . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 41.0 t -79.02 82.21 1.02 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.238 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 -179.751 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -78.95 69.8 5.17 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 124.212 1.005 . . . . 0.0 109.929 179.187 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 10.2 tt0 -68.18 136.61 53.89 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 123.607 0.763 . . . . 0.0 109.897 179.79 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 30.7 p -76.82 -70.0 0.49 Allowed 'General case' 0 N--CA 1.454 -0.244 0 CA-C-O 121.695 0.76 . . . . 0.0 109.092 171.954 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 5.3 p90 -163.16 20.67 0.08 Allowed 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 127.318 2.247 . . . . 0.0 110.366 179.906 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 19.3 m120 -59.65 -40.91 89.24 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 125.459 1.504 . . . . 0.0 112.755 -169.755 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 25.7 ttt -64.44 -41.76 96.38 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 123.063 0.545 . . . . 0.0 110.226 176.643 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 86.2 mm-40 -89.98 44.89 1.23 Allowed 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 124.124 0.97 . . . . 0.0 109.929 178.784 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 18.7 tp60 -158.43 -46.23 0.06 Allowed 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 123.782 0.833 . . . . 0.0 110.701 -175.363 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 22.6 pt20 -50.48 -35.93 31.35 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.394 1.077 . . . . 0.0 112.653 178.166 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 19.5 tpp85 -71.74 -49.42 39.31 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 124.16 0.984 . . . . 0.0 111.312 -179.522 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 38.6 mtp180 -58.94 -47.49 84.87 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 124.277 1.031 . . . . 0.0 110.078 177.125 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 36.3 t80 -53.25 -55.81 21.55 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 126.694 1.998 . . . . 0.0 110.812 174.577 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 44.7 t80 -54.15 -49.29 69.58 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 123.952 0.901 . . . . 0.0 110.682 177.132 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -56.99 -50.68 71.95 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 123.885 0.874 . . . . 0.0 110.937 -177.404 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.71 -53.03 53.65 Favored 'General case' 0 C--N 1.34 0.17 0 CA-C-O 119.413 -0.327 . . . . 0.0 110.781 178.911 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 9.2 tt -51.13 -45.12 61.52 Favored 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 125.46 1.504 . . . . 0.0 111.175 -178.087 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 15.4 m-70 -75.93 71.51 2.74 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 124.032 0.933 . . . . 0.0 109.562 175.78 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -153.48 141.57 13.9 Favored Pre-proline 0 N--CA 1.453 -0.277 0 C-N-CA 126.464 1.906 . . . . 0.0 106.833 178.191 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_endo -79.77 60.04 7.66 Favored 'Trans proline' 0 N--CA 1.457 -0.655 0 C-N-CA 123.535 2.823 . . . . 0.0 110.359 179.204 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 2.2 t30 66.26 107.09 0.04 OUTLIER 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 127.198 2.199 . . . . 0.0 111.351 177.283 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 75.9 mt -57.12 -65.78 0.56 Allowed 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 123.889 0.876 . . . . 0.0 109.645 178.258 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 43.7 p-10 -159.09 21.39 0.2 Allowed 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 124.199 1.0 . . . . 0.0 111.298 171.912 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 73.8 -52.66 0.69 Allowed 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 126.408 1.883 . . . . 0.0 111.535 -176.986 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -55.4 -68.34 0.2 Allowed 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.944 1.298 . . . . 0.0 110.66 177.958 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 99.9 mm-40 -63.04 -38.56 91.68 Favored 'General case' 0 N--CA 1.457 -0.112 0 C-N-CA 124.2 1.0 . . . . 0.0 110.856 -177.6 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -49.38 -66.3 0.42 Allowed 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 125.044 1.338 . . . . 0.0 110.415 174.239 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 14.4 m-80 -65.43 -38.55 90.24 Favored 'General case' 0 CA--C 1.527 0.082 0 CA-C-O 119.188 -0.434 . . . . 0.0 111.173 -176.668 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -54.36 -47.11 72.97 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 122.931 0.493 . . . . 0.0 111.004 177.78 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 60.1 mttp -59.11 -59.62 5.17 Favored 'General case' 0 C--N 1.342 0.245 0 N-CA-C 109.922 -0.399 . . . . 0.0 109.922 176.602 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 28.4 mm -50.52 -47.07 27.58 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.433 0 C-N-CA 123.794 0.838 . . . . 0.0 111.428 -175.76 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -66.78 -53.4 33.35 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 123.658 0.783 . . . . 0.0 111.607 -179.111 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 89.2 p -60.44 -41.15 93.47 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 123.082 0.553 . . . . 0.0 112.073 -176.738 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 68.0 mt -57.44 -44.42 84.52 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.18 0 C-N-CA 124.759 1.224 . . . . 0.0 110.259 176.073 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 73.6 mtm180 -79.98 57.21 2.57 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 123.273 0.629 . . . . 0.0 110.942 177.255 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 24.9 p-10 -99.36 -52.53 3.48 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 125.009 1.324 . . . . 0.0 109.764 171.094 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 . . . . . 0 C--O 1.251 1.134 0 C-N-CA 125.324 1.449 . . . . 0.0 109.684 177.165 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 34.7 mt-30 . . . . . 0 N--CA 1.453 -0.297 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -151.08 -49.03 0.12 Allowed 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 125.221 1.408 . . . . 0.0 110.28 178.869 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 15.6 tpt180 -58.85 -36.91 75.35 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 123.124 0.57 . . . . 0.0 111.376 176.516 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -62.13 -49.28 76.51 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 123.065 0.546 . . . . 0.0 110.289 -179.685 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 85.8 m-85 -60.24 -46.09 90.99 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 123.263 0.625 . . . . 0.0 110.991 177.565 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 46.9 t80 -54.96 -48.3 73.37 Favored 'General case' 0 C--N 1.341 0.197 0 C-N-CA 122.934 0.494 . . . . 0.0 110.699 175.475 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -63.48 -46.66 85.17 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 122.709 0.404 . . . . 0.0 110.553 -176.598 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.04 -39.81 95.85 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 124.002 0.921 . . . . 0.0 111.824 178.903 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 66.9 tp -69.02 -48.6 62.56 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 123.515 0.726 . . . . 0.0 110.238 179.148 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 17.3 m-70 -81.84 61.77 5.34 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.292 1.037 . . . . 0.0 109.164 177.631 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 62.1 t0 -146.63 82.62 8.65 Favored Pre-proline 0 CA--C 1.533 0.319 0 C-N-CA 124.886 1.274 . . . . 0.0 108.022 179.33 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -69.09 -25.18 31.94 Favored 'Trans proline' 0 N--CA 1.455 -0.748 0 C-N-CA 123.093 2.529 . . . . 0.0 112.082 -177.346 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 17.8 m-80 -54.28 -48.97 70.65 Favored 'General case' 0 C--N 1.342 0.246 0 C-N-CA 124.248 1.019 . . . . 0.0 109.937 177.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -72.24 118.71 15.46 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 107.145 -1.428 . . . . 0.0 107.145 170.124 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 7.0 p-10 -66.68 160.37 25.72 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 123.504 0.722 . . . . 0.0 110.475 178.016 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -75.18 72.6 2.28 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.103 0.961 . . . . 0.0 111.115 -175.252 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.3 tp10 -171.62 -51.22 0.02 OUTLIER 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 127.139 2.175 . . . . 0.0 106.992 175.344 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 36.1 mm-40 -71.15 -45.48 63.45 Favored 'General case' 0 CA--C 1.53 0.184 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 170.51 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 27.6 ttm180 -52.46 -49.12 65.3 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 124.645 1.178 . . . . 0.0 109.926 170.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 50.7 t30 -61.42 -42.31 98.54 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.557 0.743 . . . . 0.0 110.783 178.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.67 -40.76 88.83 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 122.883 0.473 . . . . 0.0 111.425 177.218 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 62.6 mtpt -59.22 -47.33 85.75 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 118.375 0.534 . . . . 0.0 110.722 175.478 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 33.1 mm -56.78 -53.21 44.94 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.267 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 176.258 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 58.9 mttp -79.3 55.01 1.8 Allowed 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 125.308 1.443 . . . . 0.0 110.376 177.526 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 44.5 t -165.98 -48.63 0.03 OUTLIER 'General case' 0 N--CA 1.456 -0.155 0 C-N-CA 125.625 1.57 . . . . 0.0 108.178 -179.56 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 72.2 mt -54.79 -43.57 67.7 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 171.273 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 13.3 ptp180 -73.33 -49.38 27.74 Favored 'General case' 0 C--N 1.342 0.277 0 CA-C-N 117.982 0.355 . . . . 0.0 111.411 171.243 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 28.2 t70 . . . . . 0 N--CA 1.454 -0.237 0 C-N-CA 124.016 0.926 . . . . 0.0 110.002 -173.616 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 37.0 tt0 . . . . . 0 N--CA 1.452 -0.339 0 N-CA-C 111.605 0.224 . . . . 0.0 111.605 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 -57.61 -42.29 82.97 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 123.403 0.681 . . . . 0.0 110.173 172.76 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 6.4 mmp_? -65.91 -32.19 73.55 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-O 118.834 -0.603 . . . . 0.0 112.16 175.267 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 16.7 mmm180 -65.1 -47.59 76.65 Favored 'General case' 0 C--N 1.341 0.232 0 CA-C-N 119.09 0.859 . . . . 0.0 110.836 175.606 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 47.7 m-85 -59.4 -56.11 26.21 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 122.668 0.387 . . . . 0.0 110.751 175.575 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 70.8 t80 -48.03 -52.28 20.66 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 125.626 1.57 . . . . 0.0 110.8 179.138 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 4.4 tm-20 -53.57 -57.9 9.1 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.826 1.25 . . . . 0.0 110.409 175.91 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -53.49 -44.04 68.7 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 124.006 0.922 . . . . 0.0 112.435 -177.866 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 7.1 mp -61.35 -54.32 45.28 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 124.102 0.961 . . . . 0.0 111.283 179.519 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 32.5 m-70 -76.55 -48.14 20.32 Favored 'General case' 0 N--CA 1.457 -0.124 0 N-CA-C 113.046 0.758 . . . . 0.0 113.046 -169.908 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -54.78 113.92 6.1 Favored Pre-proline 0 CA--C 1.535 0.392 0 C-N-CA 124.238 1.015 . . . . 0.0 111.709 -174.288 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -54.95 -40.87 83.59 Favored 'Trans proline' 0 C--N 1.348 0.525 0 C-N-CA 123.481 2.787 . . . . 0.0 112.177 174.34 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 5.0 p30 -57.08 -36.36 70.48 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 123.95 0.9 . . . . 0.0 111.443 177.688 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -80.09 70.74 6.75 Favored 'General case' 0 C--N 1.343 0.31 0 N-CA-C 106.723 -1.584 . . . . 0.0 106.723 169.305 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 8.5 p30 -65.95 168.53 8.0 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 125.208 1.403 . . . . 0.0 110.368 177.415 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -34.59 -64.01 0.27 Allowed 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 126.108 1.763 . . . . 0.0 114.38 -169.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -60.6 -38.64 85.33 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 -176.736 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 25.4 mm100 -70.24 -41.26 73.79 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 123.43 0.692 . . . . 0.0 110.807 179.421 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 64.4 ttp85 -60.47 -45.52 93.43 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 124.388 1.075 . . . . 0.0 110.09 175.538 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 4.6 m-80 -62.06 -40.2 94.98 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 122.885 0.474 . . . . 0.0 110.796 175.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -62.04 -44.16 97.29 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 118.228 0.467 . . . . 0.0 111.349 176.292 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 10.5 mmmm -57.15 -55.87 29.1 Favored 'General case' 0 C--N 1.342 0.273 0 C-N-CA 123.074 0.549 . . . . 0.0 109.909 174.401 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 75.2 mt -52.66 -48.84 47.75 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.298 0 C-N-CA 123.714 0.806 . . . . 0.0 110.837 -179.887 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 66.5 tttm -60.99 -49.86 75.72 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 123.925 0.89 . . . . 0.0 111.296 -178.728 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 78.6 p -64.77 -41.04 96.18 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 123.2 0.6 . . . . 0.0 111.741 -178.328 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 72.4 mt -59.47 -45.1 94.01 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 C-N-CA 123.543 0.737 . . . . 0.0 109.326 173.48 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 54.0 ttp180 -78.23 58.82 2.14 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 125.139 1.376 . . . . 0.0 109.839 176.813 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 27.7 t70 . . . . . 0 N--CA 1.455 -0.214 0 C-N-CA 124.237 1.015 . . . . 0.0 110.439 179.645 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 . . . . . 0 N--CA 1.45 -0.439 0 N-CA-C 108.032 -1.099 . . . . 0.0 108.032 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 15.3 tp60 -154.45 -58.86 0.11 Allowed 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 108.075 -1.083 . . . . 0.0 108.075 179.457 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 3.4 tpm_? -60.66 -45.31 94.6 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 170.105 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 94.8 mtt-85 -54.8 -52.24 63.26 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 124.745 1.218 . . . . 0.0 110.639 177.129 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 21.1 m-85 -59.2 -44.03 92.24 Favored 'General case' 0 C--N 1.34 0.183 0 CA-C-O 119.085 -0.483 . . . . 0.0 111.426 177.789 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 49.3 t80 -59.66 -51.62 69.0 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 118.468 0.576 . . . . 0.0 110.578 178.797 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -55.89 -42.83 76.54 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 123.563 0.745 . . . . 0.0 110.998 179.409 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.77 -57.52 9.69 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.268 0.627 . . . . 0.0 111.576 178.512 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 72.6 mt -60.08 -53.64 55.35 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 124.467 1.107 . . . . 0.0 111.401 -176.481 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 36.6 m-70 -82.64 64.35 7.23 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.156 0.982 . . . . 0.0 109.217 -177.148 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 36.9 t0 -134.32 87.18 33.77 Favored Pre-proline 0 CA--C 1.533 0.301 0 C-N-CA 125.31 1.444 . . . . 0.0 107.949 179.77 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 96.1 Cg_exo -48.01 -43.59 29.89 Favored 'Trans proline' 0 N--CA 1.459 -0.555 0 C-N-CA 124.757 3.638 . . . . 0.0 113.885 -179.12 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 20.3 m120 -60.47 -48.84 80.0 Favored 'General case' 0 CA--C 1.529 0.141 0 C-N-CA 124.04 0.936 . . . . 0.0 111.442 -176.897 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 10.4 mp -75.57 133.28 40.99 Favored 'General case' 0 N--CA 1.456 -0.172 0 C-N-CA 122.938 0.495 . . . . 0.0 109.961 -179.162 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 20.5 p30 -79.41 177.26 8.99 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.517 0.727 . . . . 0.0 111.047 178.414 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -51.55 -48.4 63.09 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 124.432 1.093 . . . . 0.0 112.271 -178.026 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 13.8 tp10 -64.86 -42.87 94.5 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 122.933 0.493 . . . . 0.0 111.173 -178.078 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 65.9 mt-30 -62.36 -41.76 98.86 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 122.863 0.465 . . . . 0.0 110.837 177.735 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 95.5 mtt180 -60.3 -50.73 72.49 Favored 'General case' 0 C--O 1.225 -0.192 0 C-N-CA 122.887 0.475 . . . . 0.0 109.897 174.529 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 78.9 m-20 -53.25 -45.13 68.67 Favored 'General case' 0 C--N 1.341 0.208 0 C-N-CA 123.598 0.759 . . . . 0.0 111.088 178.216 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.75 -43.31 90.25 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 123.559 0.743 . . . . 0.0 111.108 176.734 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 79.2 mttt -59.36 -49.77 76.53 Favored 'General case' 0 C--N 1.341 0.235 0 CA-C-O 118.231 -0.89 . . . . 0.0 111.077 173.359 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 8.3 mm -56.73 -47.58 82.34 Favored 'Isoleucine or valine' 0 C--N 1.343 0.303 0 CA-C-N 119.418 1.008 . . . . 0.0 109.738 -178.337 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 27.3 ttpp -56.63 -45.74 81.37 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.255 1.022 . . . . 0.0 111.63 177.876 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 23.1 t -62.3 -47.44 84.28 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 123.298 0.639 . . . . 0.0 111.009 178.703 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 60.3 mt -60.82 -38.31 78.67 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 C-N-CA 125.005 1.322 . . . . 0.0 110.158 178.72 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 2.4 mmp_? -65.45 -1.04 2.21 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 124.999 1.319 . . . . 0.0 114.345 178.241 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 28.2 t70 . . . . . 0 CA--C 1.534 0.345 0 C-N-CA 123.458 0.703 . . . . 0.0 111.518 173.178 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 35.8 mt-30 . . . . . 0 CA--C 1.534 0.338 0 CA-C-O 118.899 -0.572 . . . . 0.0 111.55 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 20.8 tm0? -53.72 -36.97 62.84 Favored 'General case' 0 C--N 1.343 0.314 0 C-N-CA 124.46 1.104 . . . . 0.0 110.131 174.795 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 3.3 mpt_? -63.35 -54.91 29.45 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 123.897 0.879 . . . . 0.0 109.739 179.334 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 19.7 mmm180 -58.58 -47.92 82.67 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 124.04 0.936 . . . . 0.0 110.284 -178.257 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 26.8 t80 -54.55 -48.76 71.65 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 127.367 2.267 . . . . 0.0 111.646 175.874 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 79.7 t80 -65.0 -45.2 86.57 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 124.886 1.274 . . . . 0.0 110.967 -179.573 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -56.46 -51.95 66.51 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.339 0.656 . . . . 0.0 110.081 174.661 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.05 -41.44 87.9 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 124.102 0.961 . . . . 0.0 111.68 179.413 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 49.9 tp -58.56 -46.1 87.58 Favored 'General case' 0 C--N 1.339 0.14 0 C-N-CA 123.759 0.823 . . . . 0.0 110.137 177.643 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 23.0 m-70 -96.67 55.08 1.37 Allowed 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 123.981 0.912 . . . . 0.0 110.148 -178.415 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -142.28 89.17 8.67 Favored Pre-proline 0 CA--C 1.533 0.302 0 C-N-CA 123.816 0.846 . . . . 0.0 109.656 179.346 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_exo -53.48 -30.2 52.8 Favored 'Trans proline' 0 N--CA 1.458 -0.56 0 C-N-CA 124.397 3.398 . . . . 0.0 113.84 175.846 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 11.9 m120 -52.81 -47.71 67.45 Favored 'General case' 0 C--N 1.343 0.316 0 C-N-CA 124.294 1.038 . . . . 0.0 110.707 179.52 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 46.4 mt -69.14 118.45 12.05 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 107.061 -1.459 . . . . 0.0 107.061 169.555 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 12.7 p30 -61.75 156.57 19.99 Favored 'General case' 0 CA--C 1.529 0.155 0 C-N-CA 123.193 0.597 . . . . 0.0 110.96 -178.382 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 9.6 mp0 -47.78 -50.97 24.1 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 125.181 1.393 . . . . 0.0 111.995 -175.778 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -58.37 -59.99 4.49 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 123.104 0.561 . . . . 0.0 111.028 -175.22 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 29.5 mm100 -62.65 -45.56 92.25 Favored 'General case' 0 CA--C 1.529 0.155 0 C-N-CA 123.23 0.612 . . . . 0.0 111.123 -177.405 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 41.2 ttp180 -56.39 -58.93 5.92 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 123.996 0.918 . . . . 0.0 110.372 179.9 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 62.3 m-20 -62.47 -35.27 78.79 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 123.563 0.745 . . . . 0.0 111.343 -176.752 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -62.52 -48.92 77.42 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 122.811 0.444 . . . . 0.0 110.868 175.232 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 59.6 mtpt -59.97 -46.82 88.18 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 123.603 0.761 . . . . 0.0 110.823 178.579 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 24.9 mm -54.41 -57.45 6.18 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.261 0 C-N-CA 123.708 0.803 . . . . 0.0 109.658 174.891 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 82.0 tttt -80.47 59.2 3.42 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.598 1.159 . . . . 0.0 109.787 178.66 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 46.5 t -168.86 -46.32 0.02 OUTLIER 'General case' 0 N--CA 1.456 -0.174 0 C-N-CA 126.507 1.923 . . . . 0.0 107.929 179.824 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 53.2 mt -53.12 -54.21 18.49 Favored 'Isoleucine or valine' 0 C--N 1.342 0.277 0 C-N-CA 123.717 0.807 . . . . 0.0 109.075 169.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 9.8 ptp180 -82.28 64.4 6.92 Favored 'General case' 0 C--N 1.342 0.248 0 CA-C-O 121.069 0.461 . . . . 0.0 111.216 175.749 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 . . . . . 0 CA--C 1.533 0.299 0 C-N-CA 123.474 0.71 . . . . 0.0 109.613 169.816 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 80.5 mt-30 . . . . . 0 N--CA 1.453 -0.317 0 CA-C-O 117.903 -1.046 . . . . 0.0 113.553 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 -51.68 -39.06 57.56 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 120.286 1.403 . . . . 0.0 111.451 175.535 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 25.6 mmm180 -56.32 -65.96 0.52 Allowed 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 124.079 0.952 . . . . 0.0 110.778 175.794 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 58.2 mtp180 -50.5 -43.56 55.67 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 125.234 1.413 . . . . 0.0 111.561 178.812 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 80.9 t80 -61.04 -53.8 52.69 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 126.919 2.087 . . . . 0.0 111.695 -177.239 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -72.02 -32.59 67.29 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 118.468 0.576 . . . . 0.0 111.171 -179.75 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 25.5 mm-40 -61.46 -42.39 98.7 Favored 'General case' 0 CA--C 1.532 0.269 0 O-C-N 121.628 -0.67 . . . . 0.0 110.182 172.763 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.35 -47.93 83.64 Favored 'General case' 0 N--CA 1.456 -0.172 0 C-N-CA 123.198 0.599 . . . . 0.0 110.483 176.191 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 34.1 tp -50.6 -44.47 57.04 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.682 1.193 . . . . 0.0 110.991 175.419 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 28.1 m170 -78.54 -40.21 35.62 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 123.751 0.82 . . . . 0.0 113.188 -174.113 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.31 140.89 94.48 Favored Pre-proline 0 CA--C 1.537 0.446 0 CA-C-N 119.056 0.844 . . . . 0.0 111.36 -170.011 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_endo -78.86 -37.83 0.55 Allowed 'Trans proline' 0 N--CA 1.455 -0.78 0 C-N-CA 123.289 2.659 . . . . 0.0 112.43 -178.032 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 3.4 p-10 -58.14 -40.85 82.37 Favored 'General case' 0 C--N 1.341 0.23 0 N-CA-C 113.798 1.036 . . . . 0.0 113.798 -169.808 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 68.2 mt -70.3 117.91 12.45 Favored 'General case' 0 N--CA 1.455 -0.186 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 173.019 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 32.9 p-10 -73.1 176.65 5.63 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 123.376 0.67 . . . . 0.0 110.73 178.779 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.9 mp0 -81.54 55.82 2.77 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 123.645 0.778 . . . . 0.0 109.953 179.507 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 56.5 mt-10 -147.17 -60.92 0.28 Allowed 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 126.881 2.072 . . . . 0.0 105.958 169.974 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 37.2 mm-40 -67.81 -44.08 78.14 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 123.892 0.877 . . . . 0.0 110.439 178.709 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 20.1 ttm180 -58.63 -55.96 28.38 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 123.072 0.549 . . . . 0.0 109.634 177.846 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 22.9 m120 -62.07 -37.91 86.82 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-O 119.158 -0.449 . . . . 0.0 111.374 -177.325 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.3 -48.72 80.58 Favored 'General case' 0 C--N 1.341 0.21 0 CA-C-N 118.239 0.472 . . . . 0.0 110.935 175.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 25.0 mmtp -56.73 -56.86 16.13 Favored 'General case' 0 C--N 1.341 0.203 0 C-N-CA 123.127 0.571 . . . . 0.0 110.338 176.421 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 23.1 mm -50.98 -57.74 2.53 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.235 0 C-N-CA 123.948 0.899 . . . . 0.0 110.408 -179.151 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -53.28 -50.38 64.98 Favored 'General case' 0 N--CA 1.456 -0.164 0 C-N-CA 125.065 1.346 . . . . 0.0 111.044 -179.134 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 35.4 t -58.33 -46.26 86.56 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.694 0.798 . . . . 0.0 111.492 -179.09 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 59.6 mt -65.8 -50.13 72.7 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 C-N-CA 123.008 0.523 . . . . 0.0 110.558 -175.875 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 18.5 ptp180 -66.51 -33.72 76.32 Favored 'General case' 0 C--N 1.342 0.272 0 CA-C-N 118.223 0.465 . . . . 0.0 112.044 179.149 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 37.3 t70 . . . . . 0 CA--C 1.531 0.231 0 N-CA-C 108.5 -0.926 . . . . 0.0 108.5 171.881 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 17.6 tt0 . . . . . 0 CA--C 1.534 0.337 0 CA-C-O 120.964 0.412 . . . . 0.0 110.725 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 19.1 tp60 -163.54 -56.91 0.04 OUTLIER 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 124.435 1.094 . . . . 0.0 110.059 179.288 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 30.9 tpt180 -72.39 -77.98 0.09 Allowed 'General case' 0 C--N 1.341 0.227 0 C-N-CA 122.854 0.461 . . . . 0.0 110.895 -172.701 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.77 -26.83 66.03 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 122.672 0.389 . . . . 0.0 111.562 178.733 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 76.3 t80 -61.22 -56.66 18.12 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 126.425 1.89 . . . . 0.0 110.514 175.486 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 55.7 t80 -58.47 -49.64 76.63 Favored 'General case' 0 C--N 1.341 0.207 0 C-N-CA 122.649 0.38 . . . . 0.0 110.215 176.79 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -56.89 -44.73 82.61 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 122.838 0.455 . . . . 0.0 111.451 -177.827 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.95 -53.87 52.76 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 123.589 0.755 . . . . 0.0 111.49 179.719 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 55.1 tp -63.45 -52.67 60.43 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 122.766 0.426 . . . . 0.0 110.554 -178.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 24.8 m-70 -81.43 64.39 6.13 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 124.465 1.106 . . . . 0.0 109.696 -179.084 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -150.82 115.25 3.22 Favored Pre-proline 0 CA--C 1.533 0.302 0 C-N-CA 124.89 1.276 . . . . 0.0 108.181 175.853 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 94.4 Cg_endo -77.82 -25.11 8.01 Favored 'Trans proline' 0 N--CA 1.455 -0.754 0 C-N-CA 123.249 2.633 . . . . 0.0 112.052 -177.85 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 -56.13 -55.18 36.18 Favored 'General case' 0 C--N 1.342 0.265 0 C-N-CA 123.775 0.83 . . . . 0.0 110.619 -178.796 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 91.0 mt -79.41 141.37 36.9 Favored 'General case' 0 N--CA 1.453 -0.28 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 172.64 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 43.8 p-10 -96.68 176.51 5.98 Favored 'General case' 0 C--O 1.233 0.189 0 C-N-CA 124.493 1.117 . . . . 0.0 110.396 179.485 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -79.37 62.4 3.7 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 124.123 0.969 . . . . 0.0 110.453 175.514 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 64.8 mt-10 -148.2 -47.27 0.16 Allowed 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 127.18 2.192 . . . . 0.0 106.794 169.773 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 22.9 mm100 -80.34 -56.65 4.05 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 124.063 0.945 . . . . 0.0 109.71 173.365 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 21.7 ptt180 -68.0 -41.83 81.66 Favored 'General case' 0 C--N 1.341 0.23 0 CA-C-O 119.526 -0.273 . . . . 0.0 111.151 -173.722 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 43.2 p-10 -62.93 -35.81 81.32 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 117.951 0.341 . . . . 0.0 111.622 -178.112 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -60.73 -44.81 96.18 Favored 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 123.687 0.795 . . . . 0.0 110.567 175.199 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 57.0 mtmt -61.44 -48.91 79.0 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-O 119.423 -0.322 . . . . 0.0 110.712 175.729 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 27.9 mm -55.93 -45.02 79.86 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 C-N-CA 124.056 0.942 . . . . 0.0 111.326 179.294 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 88.6 mttt -61.5 -47.43 85.68 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 123.704 0.801 . . . . 0.0 110.689 175.425 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 23.1 t -61.92 -43.57 98.57 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 123.915 0.886 . . . . 0.0 112.012 -177.589 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 58.4 mt -61.59 -35.58 68.0 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.222 0 C-N-CA 124.102 0.961 . . . . 0.0 109.905 177.401 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 85.3 mtm180 -78.31 52.59 1.15 Allowed 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.27 0.628 . . . . 0.0 111.479 173.248 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 . . . . . 0 CA--C 1.532 0.273 0 C-N-CA 124.491 1.116 . . . . 0.0 109.445 169.579 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 26.8 mt-30 . . . . . 0 CA--C 1.536 0.407 0 N-CA-C 112.061 0.393 . . . . 0.0 112.061 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 11.9 tp-100 -66.38 -46.08 77.87 Favored 'General case' 0 C--N 1.341 0.23 0 CA-C-N 118.944 0.793 . . . . 0.0 110.042 179.638 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 9.1 mmm180 -58.4 -36.59 73.79 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.785 0.834 . . . . 0.0 111.426 173.042 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 12.0 mmp_? -68.52 -37.22 79.84 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 123.581 0.753 . . . . 0.0 110.534 179.634 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 15.6 m-30 -65.29 -48.86 71.67 Favored 'General case' 0 N--CA 1.455 -0.196 0 CA-C-O 119.428 -0.32 . . . . 0.0 110.157 172.198 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 21.3 m-85 -79.39 60.27 3.12 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 123.904 0.882 . . . . 0.0 109.987 175.716 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.7 tm-20 -175.57 -50.33 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 127.182 2.193 . . . . 0.0 106.99 -174.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -73.8 -53.03 11.18 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 124.179 0.992 . . . . 0.0 110.896 175.856 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 58.5 tp -73.4 -54.89 7.22 Favored 'General case' 0 C--N 1.34 0.166 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 175.157 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 56.0 m-70 -84.01 59.78 5.48 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 123.423 0.689 . . . . 0.0 109.696 178.898 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -94.57 137.62 22.53 Favored Pre-proline 0 CA--C 1.533 0.322 0 C-N-CA 124.439 1.096 . . . . 0.0 108.239 174.531 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_exo -42.43 -52.94 4.01 Favored 'Trans proline' 0 N--CA 1.458 -0.59 0 C-N-CA 124.004 3.136 . . . . 0.0 114.136 173.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 5.9 p-10 -160.31 131.94 5.95 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 123.621 0.768 . . . . 0.0 110.54 -179.573 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 92.8 mt -140.5 -126.95 0.11 Allowed 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 125.4 1.48 . . . . 0.0 107.104 172.704 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 51.6 p-10 -155.07 23.58 0.43 Allowed 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.768 0.827 . . . . 0.0 111.957 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 74.17 -54.28 0.68 Allowed 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 125.91 1.684 . . . . 0.0 112.109 -177.47 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -52.58 -59.64 4.22 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 124.465 1.106 . . . . 0.0 110.24 178.067 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 83.8 mt-30 -58.82 -43.31 90.57 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 124.803 1.241 . . . . 0.0 110.897 178.652 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 59.2 ttm-85 -55.51 -54.98 37.13 Favored 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 124.807 1.243 . . . . 0.0 111.218 -177.502 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 28.8 m-80 -71.23 -38.16 71.99 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 123.061 0.544 . . . . 0.0 111.146 179.804 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.19 -43.74 87.69 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 118.434 0.561 . . . . 0.0 111.233 177.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 58.6 mtpt -59.59 -50.99 71.76 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 123.129 0.571 . . . . 0.0 109.929 175.709 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 11.6 mm -52.99 -51.75 35.23 Favored 'Isoleucine or valine' 0 C--N 1.341 0.226 0 C-N-CA 123.019 0.527 . . . . 0.0 111.045 178.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 67.6 mttm -57.68 -49.63 75.85 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 123.527 0.731 . . . . 0.0 110.878 179.683 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 32.5 t -57.77 -51.29 70.16 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 124.072 0.949 . . . . 0.0 111.472 -179.119 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 67.1 mt -58.97 -58.26 7.66 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.223 0 C-N-CA 124.765 1.226 . . . . 0.0 109.435 179.722 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 61.1 ttm-85 -55.44 -42.28 73.99 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 125.136 1.374 . . . . 0.0 111.39 -175.721 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 37.9 t70 . . . . . 0 CA--C 1.534 0.343 0 C-N-CA 123.957 0.903 . . . . 0.0 109.249 172.762 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 17.4 mm100 . . . . . 0 C--O 1.225 -0.228 0 CA-C-O 119.092 -0.48 . . . . 0.0 110.747 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 16.1 mm100 -67.3 -38.64 85.32 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 123.753 0.821 . . . . 0.0 111.447 -177.188 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 4.0 tmt_? -62.84 -54.95 30.93 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 124.432 1.093 . . . . 0.0 110.265 176.531 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 89.4 mtt-85 -67.56 -32.73 73.7 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 124.067 0.947 . . . . 0.0 111.185 -177.144 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 3.5 t80 -56.98 -53.79 54.06 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 125.275 1.43 . . . . 0.0 110.294 169.953 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 70.9 t80 -57.42 -48.06 80.13 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 123.377 0.671 . . . . 0.0 110.724 179.747 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 73.2 mt-10 -56.13 -50.02 72.28 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 123.119 0.568 . . . . 0.0 111.077 175.791 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -56.81 -45.09 82.49 Favored 'General case' 0 C--N 1.341 0.207 0 C-N-CA 124.138 0.975 . . . . 0.0 111.462 179.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 1.1 tt -50.8 -41.26 57.05 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 124.454 1.102 . . . . 0.0 109.95 175.01 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 11.9 m-70 -100.52 25.64 7.53 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 124.437 1.095 . . . . 0.0 112.678 -176.169 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 80.0 m-20 -69.05 151.98 96.97 Favored Pre-proline 0 CA--C 1.538 0.486 0 CA-C-N 119.13 0.877 . . . . 0.0 109.946 174.884 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_exo -50.75 -63.64 0.27 Allowed 'Trans proline' 0 C--N 1.351 0.663 0 C-N-CA 123.962 3.108 . . . . 0.0 114.46 -173.831 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 -162.96 84.61 0.52 Allowed 'General case' 0 N--CA 1.456 -0.141 0 C-N-CA 123.189 0.596 . . . . 0.0 109.572 -176.077 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 89.6 mt -122.94 129.24 51.33 Favored 'General case' 0 N--CA 1.456 -0.135 0 N-CA-C 106.267 -1.753 . . . . 0.0 106.267 172.747 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 1.7 p30 -69.24 163.93 23.88 Favored 'General case' 0 CA--C 1.529 0.157 0 N-CA-C 112.883 0.697 . . . . 0.0 112.883 -169.533 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 -58.02 -28.52 64.52 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 124.372 1.069 . . . . 0.0 113.074 -172.002 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -57.64 -50.29 73.66 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 119.069 0.849 . . . . 0.0 109.902 173.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 47.5 mt-30 -65.39 -40.13 93.07 Favored 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 124.278 1.031 . . . . 0.0 110.378 -179.885 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 5.8 mmp_? -62.25 -65.0 0.75 Allowed 'General case' 0 C--N 1.342 0.257 0 N-CA-C 109.244 -0.651 . . . . 0.0 109.244 177.896 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 61.2 t30 -50.14 -38.7 40.47 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 124.909 1.284 . . . . 0.0 112.368 -176.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -54.6 -49.25 70.91 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 118.297 0.499 . . . . 0.0 111.103 174.013 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 95.5 mttt -62.54 -55.87 23.35 Favored 'General case' 0 C--N 1.342 0.241 0 CA-C-O 118.938 -0.553 . . . . 0.0 110.807 173.831 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 4.9 mm -57.73 -37.96 62.4 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 CA-C-N 118.294 0.497 . . . . 0.0 110.499 -171.056 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 17.6 tppt? -60.2 -50.98 71.51 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 124.265 1.026 . . . . 0.0 110.453 176.701 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 18.1 m -59.55 -44.96 93.09 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.59 0.756 . . . . 0.0 111.037 179.067 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 48.8 mt -62.69 -47.72 91.57 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 C-N-CA 125.386 1.474 . . . . 0.0 110.226 -179.347 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 78.4 mtm180 -56.91 -46.53 81.92 Favored 'General case' 0 C--N 1.34 0.193 0 C-N-CA 123.77 0.828 . . . . 0.0 110.282 174.325 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 53.0 m-20 . . . . . 0 CA--C 1.535 0.381 0 C-N-CA 123.773 0.829 . . . . 0.0 110.992 -178.846 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 16.6 mm100 . . . . . 0 CA--C 1.53 0.203 0 N-CA-C 110.557 -0.164 . . . . 0.0 110.557 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 62.0 mm-40 -59.35 -39.57 83.62 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 124.015 0.926 . . . . 0.0 111.63 179.25 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 9.7 mmm180 -58.95 -56.91 16.11 Favored 'General case' 0 N--CA 1.456 -0.167 0 CA-C-N 118.143 0.428 . . . . 0.0 110.909 176.406 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 19.8 ptt180 -66.07 -30.69 71.25 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 112.557 0.577 . . . . 0.0 112.557 -177.582 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 15.5 m-85 -58.69 -52.01 67.52 Favored 'General case' 0 C--N 1.343 0.311 0 CA-C-N 118.494 0.588 . . . . 0.0 110.344 169.874 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 47.5 t80 -58.37 -48.65 79.94 Favored 'General case' 0 C--N 1.341 0.203 0 C-N-CA 122.994 0.517 . . . . 0.0 110.657 -179.807 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -56.99 -46.99 81.87 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 123.355 0.662 . . . . 0.0 111.03 -179.742 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.62 -54.09 44.82 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 123.402 0.681 . . . . 0.0 111.514 178.716 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 61.3 tp -59.86 -45.77 91.39 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 124.572 1.149 . . . . 0.0 111.215 -176.428 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 22.9 m-70 -89.28 16.24 7.71 Favored 'General case' 0 CA--C 1.537 0.481 0 C-N-CA 124.309 1.043 . . . . 0.0 111.994 -179.617 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -68.22 135.45 91.33 Favored Pre-proline 0 CA--C 1.533 0.311 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 172.863 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -67.67 -29.16 36.61 Favored 'Trans proline' 0 N--CA 1.457 -0.651 0 C-N-CA 122.456 2.104 . . . . 0.0 112.668 -176.39 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 27.5 m-80 -83.1 62.88 6.84 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.685 0.794 . . . . 0.0 110.516 -175.884 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 20.7 mt -80.3 87.1 5.6 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-O 121.683 0.754 . . . . 0.0 110.234 177.794 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 52.3 p-10 -98.7 17.36 19.47 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 125.602 1.561 . . . . 0.0 110.775 171.413 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.9 mp0 71.46 -55.98 0.64 Allowed 'General case' 0 C--N 1.345 0.408 0 C-N-CA 127.223 2.209 . . . . 0.0 111.277 -174.035 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -45.24 -54.03 7.55 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 126.246 1.819 . . . . 0.0 112.219 -178.191 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 37.1 mt-30 -60.52 -54.13 49.15 Favored 'General case' 0 C--N 1.34 0.176 0 C-N-CA 123.301 0.641 . . . . 0.0 110.56 -176.34 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 78.3 ttt180 -54.33 -56.19 20.99 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 124.117 0.967 . . . . 0.0 110.998 -179.253 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 11.4 m-80 -59.74 -50.3 74.38 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 122.939 0.495 . . . . 0.0 110.854 -177.537 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -54.64 -50.21 68.69 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 123.262 0.625 . . . . 0.0 111.409 -179.828 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 27.1 mmmt -61.39 -54.02 49.1 Favored 'General case' 0 N--CA 1.454 -0.225 0 C-N-CA 122.769 0.428 . . . . 0.0 110.83 179.603 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 39.7 mt -54.87 -46.53 75.68 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 C-N-CA 123.282 0.633 . . . . 0.0 110.999 -178.159 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 60.9 mtpt -58.16 -48.25 80.85 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 123.888 0.875 . . . . 0.0 110.972 176.227 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 50.3 m -58.29 -52.7 64.49 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 117.917 0.326 . . . . 0.0 111.121 179.13 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 41.1 mt -63.37 -49.06 84.38 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.251 0 C-N-CA 124.312 1.045 . . . . 0.0 110.751 -173.891 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 12.3 ptm180 -64.81 -34.79 79.2 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 118.018 0.372 . . . . 0.0 111.634 -177.087 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 84.1 m-20 . . . . . 0 C--N 1.341 0.237 0 C-N-CA 122.761 0.424 . . . . 0.0 110.235 175.539 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 90.0 mt-30 . . . . . 0 N--CA 1.453 -0.304 0 CA-C-O 118.921 -0.562 . . . . 0.0 112.154 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 11.5 tt0 -60.23 -32.56 71.24 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 118.876 0.762 . . . . 0.0 111.398 177.254 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 5.1 mmp_? -64.14 -47.02 81.53 Favored 'General case' 0 N--CA 1.456 -0.151 0 C-N-CA 123.245 0.618 . . . . 0.0 110.12 173.858 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 79.4 mtt85 -60.49 -44.33 96.07 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 123.42 0.688 . . . . 0.0 110.139 178.151 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 14.1 m-30 -57.67 -45.71 85.23 Favored 'General case' 0 C--O 1.225 -0.215 0 C-N-CA 123.562 0.745 . . . . 0.0 111.592 174.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 87.0 t80 -58.43 -52.27 66.34 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 118.648 0.658 . . . . 0.0 110.373 178.795 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -56.9 -52.41 65.25 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.564 0.746 . . . . 0.0 111.178 179.841 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.23 -51.13 70.87 Favored 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 124.739 1.216 . . . . 0.0 111.555 -178.004 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 59.6 tp -62.11 -50.2 72.87 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 124.541 1.136 . . . . 0.0 110.34 -177.548 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 18.0 m-70 -82.17 62.78 6.06 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.8 0.84 . . . . 0.0 109.674 178.008 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -154.43 121.93 2.89 Favored Pre-proline 0 CA--C 1.535 0.371 0 C-N-CA 123.916 0.886 . . . . 0.0 109.414 176.491 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo -80.06 -32.75 1.31 Allowed 'Trans proline' 0 N--CA 1.456 -0.735 0 C-N-CA 123.458 2.772 . . . . 0.0 112.319 -178.311 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 30.3 t30 -53.52 -47.88 69.52 Favored 'General case' 0 C--N 1.343 0.298 0 C-N-CA 124.231 1.012 . . . . 0.0 110.923 -176.246 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -75.87 88.51 2.88 Favored 'General case' 0 N--CA 1.455 -0.219 0 N-CA-C 105.272 -2.121 . . . . 0.0 105.272 169.5 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 -81.69 55.45 2.7 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.532 1.133 . . . . 0.0 112.811 -169.639 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 15.3 tt0 69.88 164.94 0.27 Allowed 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.879 1.272 . . . . 0.0 110.969 -179.353 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.9 tp10 71.8 -64.01 0.4 Allowed 'General case' 0 N--CA 1.456 -0.163 0 C-N-CA 127.031 2.132 . . . . 0.0 110.775 -178.033 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 33.4 mm-40 -59.58 -45.39 92.02 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 124.341 1.057 . . . . 0.0 109.631 171.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 39.3 ttp180 -56.13 -53.32 58.51 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 125.684 1.594 . . . . 0.0 110.513 176.934 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 9.8 m120 -61.81 -43.45 98.82 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 124.467 1.107 . . . . 0.0 110.742 -179.579 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -60.83 -51.23 70.18 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 124.081 0.952 . . . . 0.0 111.206 -178.541 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 61.1 pttt -66.52 -34.9 78.95 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 118.345 0.52 . . . . 0.0 111.594 -178.101 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 5.3 mt -58.95 -48.08 87.67 Favored 'Isoleucine or valine' 0 C--N 1.342 0.251 0 CA-C-O 118.962 -0.542 . . . . 0.0 109.84 170.407 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 52.0 tptt -60.95 -37.32 81.93 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 118.754 0.706 . . . . 0.0 111.435 179.228 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 19.4 m -59.61 -41.63 90.78 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 118.507 0.594 . . . . 0.0 111.188 174.948 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 70.7 mt -65.61 -60.61 2.44 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.453 0 C-N-CA 123.831 0.852 . . . . 0.0 109.709 177.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 3.5 ptm180 -92.09 69.47 5.31 Favored 'General case' 0 C--N 1.341 0.219 0 C-N-CA 123.783 0.833 . . . . 0.0 110.191 174.197 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 38.7 t70 . . . . . 0 CA--C 1.532 0.253 0 N-CA-C 109.91 -0.404 . . . . 0.0 109.91 178.954 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 29.1 mm100 . . . . . 0 N--CA 1.453 -0.285 0 CA-C-O 118.189 -0.91 . . . . 0.0 112.012 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -36.42 -41.11 0.27 Allowed 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 125.937 1.695 . . . . 0.0 114.204 177.673 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 33.3 tpt85 -69.97 -53.98 15.33 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.352 0.661 . . . . 0.0 111.075 -178.738 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 9.8 mpt_? -61.47 -47.29 86.37 Favored 'General case' 0 CA--C 1.53 0.212 0 C-N-CA 124.446 1.098 . . . . 0.0 109.577 -178.912 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 88.4 t80 -49.42 -51.64 33.96 Favored 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 127.709 2.403 . . . . 0.0 111.33 172.67 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 40.7 t80 -58.41 -47.41 84.01 Favored 'General case' 0 C--N 1.341 0.197 0 CA-C-O 119.019 -0.515 . . . . 0.0 110.803 177.388 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 46.4 mm-40 -58.43 -51.69 68.75 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 118.68 0.673 . . . . 0.0 110.69 178.909 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -56.45 -45.59 80.76 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 124.374 1.07 . . . . 0.0 111.72 -178.994 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 57.7 tp -64.87 -53.47 46.11 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 123.9 0.88 . . . . 0.0 110.384 178.506 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 16.8 m-70 -82.28 57.99 3.86 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 124.643 1.177 . . . . 0.0 109.877 -179.782 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -156.51 78.02 4.15 Favored Pre-proline 0 CA--C 1.534 0.356 0 C-N-CA 124.904 1.282 . . . . 0.0 107.79 178.266 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -82.47 59.08 6.78 Favored 'Trans proline' 0 N--CA 1.456 -0.683 0 C-N-CA 124.323 3.349 . . . . 0.0 110.568 -172.659 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 3.1 p-10 -154.47 -30.9 0.11 Allowed 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 124.806 1.242 . . . . 0.0 111.556 -176.372 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -62.83 153.61 32.55 Favored 'General case' 0 C--N 1.343 0.293 0 CA-C-N 118.742 0.701 . . . . 0.0 109.995 170.782 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 8.9 p30 -65.92 132.48 48.73 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 175.247 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -80.76 65.27 5.84 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 124.276 1.03 . . . . 0.0 108.585 -178.295 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.9 tp10 -152.07 -52.59 0.12 Allowed 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 126.805 2.042 . . . . 0.0 106.636 179.515 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 35.0 mt-30 -63.62 -65.45 0.68 Allowed 'General case' 0 C--N 1.341 0.218 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 171.678 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 18.7 ptt180 -61.59 -33.62 74.2 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-O 119.075 -0.488 . . . . 0.0 111.728 178.266 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 24.5 t-20 -63.88 -49.4 72.87 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 118.482 0.583 . . . . 0.0 111.191 179.031 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.34 -47.55 83.42 Favored 'General case' 0 C--N 1.339 0.15 0 C-N-CA 123.552 0.741 . . . . 0.0 110.864 178.159 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 57.8 mtpt -56.36 -61.19 2.57 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 123.51 0.724 . . . . 0.0 110.176 177.266 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 38.5 mt -49.89 -53.0 11.85 Favored 'Isoleucine or valine' 0 C--N 1.338 0.076 0 C-N-CA 124.946 1.298 . . . . 0.0 110.994 -178.843 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 6.9 ttpm? -53.37 -54.05 42.3 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 124.429 1.092 . . . . 0.0 111.311 178.86 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 51.0 m -56.82 -48.12 78.72 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 122.656 0.382 . . . . 0.0 111.647 179.883 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 67.4 mt -62.27 -50.83 78.39 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.267 0 C-N-CA 124.314 1.046 . . . . 0.0 110.697 -175.278 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 36.2 ptt85 -71.93 -31.85 66.77 Favored 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 112.484 0.55 . . . . 0.0 112.484 -177.301 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 87.6 m-20 . . . . . 0 C--N 1.341 0.226 0 CA-C-N 118.212 0.46 . . . . 0.0 110.855 178.689 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 12.5 mm100 . . . . . 0 CA--C 1.531 0.233 0 CA-C-O 119.901 -0.095 . . . . 0.0 111.157 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 82.2 mt-30 -53.35 -42.49 66.87 Favored 'General case' 0 C--N 1.34 0.182 0 C-N-CA 124.317 1.047 . . . . 0.0 111.337 177.362 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 80.4 mmt-85 -64.26 -42.05 96.65 Favored 'General case' 0 N--CA 1.456 -0.165 0 C-N-CA 123.4 0.68 . . . . 0.0 110.611 -178.16 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.48 -40.25 95.32 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-O 119.546 -0.264 . . . . 0.0 110.54 173.951 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 20.6 m-85 -62.66 -34.07 76.34 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-O 118.716 -0.659 . . . . 0.0 111.496 175.673 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 19.5 m-85 -76.72 55.12 1.03 Allowed 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 119.075 0.852 . . . . 0.0 110.342 172.449 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -178.56 -55.93 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 127.183 2.193 . . . . 0.0 107.676 -179.034 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -80.53 -47.52 14.12 Favored 'General case' 0 C--N 1.34 0.185 0 C-N-CA 123.951 0.9 . . . . 0.0 111.579 -179.366 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.0 tt -78.01 -56.49 4.44 Favored 'General case' 0 C--N 1.338 0.072 0 N-CA-C 107.956 -1.127 . . . . 0.0 107.956 -178.079 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 62.7 m-70 -84.45 54.41 2.99 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 124.422 1.089 . . . . 0.0 109.392 176.95 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -87.45 141.55 32.46 Favored Pre-proline 0 CA--C 1.533 0.318 0 C-N-CA 123.649 0.779 . . . . 0.0 109.785 -179.818 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_exo -43.52 -59.97 0.9 Allowed 'Trans proline' 0 N--CA 1.455 -0.771 0 C-N-CA 124.212 3.275 . . . . 0.0 115.343 173.015 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 9.4 p30 -157.53 25.91 0.29 Allowed 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 115.001 1.482 . . . . 0.0 115.001 -169.969 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 28.5 mt -63.1 133.24 54.14 Favored 'General case' 0 C--N 1.34 0.182 0 CA-C-N 119.647 1.112 . . . . 0.0 109.375 169.974 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 14.2 p30 -65.05 163.82 14.05 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 123.715 0.806 . . . . 0.0 110.527 175.847 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -51.48 -49.11 62.46 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 124.05 0.94 . . . . 0.0 112.314 -175.046 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -58.2 -57.23 13.79 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.312 0.645 . . . . 0.0 110.959 -177.331 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 92.0 mm-40 -66.62 -43.47 84.67 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 123.073 0.549 . . . . 0.0 111.495 -175.217 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 22.3 ttm-85 -56.02 -54.55 43.54 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.761 0.824 . . . . 0.0 109.619 175.889 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -57.17 -40.7 77.81 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 123.877 0.871 . . . . 0.0 111.624 178.282 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -60.42 -45.59 93.07 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 123.061 0.544 . . . . 0.0 111.088 178.429 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 12.3 mmmm -58.75 -47.48 84.51 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 122.591 0.356 . . . . 0.0 110.707 175.56 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 48.2 mm -57.15 -44.49 83.42 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 CA-C-N 117.949 0.34 . . . . 0.0 110.701 177.007 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 1.3 tppm? -61.4 -39.87 92.3 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 123.529 0.732 . . . . 0.0 111.015 178.23 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 20.1 m -60.66 -42.07 96.27 Favored 'General case' 0 CA--C 1.533 0.302 0 O-C-N 121.732 -0.605 . . . . 0.0 111.187 175.301 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 43.2 mt -72.1 -40.37 66.67 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 C-N-CA 124.103 0.961 . . . . 0.0 111.44 -177.052 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 12.2 ptt180 -133.38 91.88 2.92 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 124.424 1.09 . . . . 0.0 108.244 174.477 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 17.5 p-10 . . . . . 0 CA--C 1.536 0.426 0 C-N-CA 125.946 1.699 . . . . 0.0 112.589 178.261 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 44.3 tt0 . . . . . 0 N--CA 1.453 -0.324 0 CA-C-O 119.417 -0.325 . . . . 0.0 110.503 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 18.5 pt20 -59.41 -30.64 68.61 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 123.916 0.887 . . . . 0.0 111.789 -179.561 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 49.5 ttt-85 -66.1 -59.33 3.88 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.832 0.853 . . . . 0.0 110.999 177.278 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 22.8 mtp-105 -56.52 -38.15 71.42 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 124.748 1.219 . . . . 0.0 111.124 177.382 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 23.5 t80 -60.9 -53.46 56.98 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 125.61 1.564 . . . . 0.0 110.824 178.021 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 45.0 t80 -57.11 -49.12 76.88 Favored 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 123.806 0.842 . . . . 0.0 110.11 177.203 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 5.9 tm-20 -53.45 -57.21 11.46 Favored 'General case' 0 C--N 1.341 0.199 0 C-N-CA 123.549 0.74 . . . . 0.0 109.978 178.47 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -53.49 -55.66 23.5 Favored 'General case' 0 N--CA 1.456 -0.174 0 C-N-CA 124.052 0.941 . . . . 0.0 111.232 -178.084 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 63.3 tp -59.1 -54.65 44.6 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 124.462 1.105 . . . . 0.0 111.754 -176.467 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 21.3 m-70 -70.95 -37.78 72.84 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 122.956 0.502 . . . . 0.0 112.11 -173.532 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -67.86 120.63 75.17 Favored Pre-proline 0 CA--C 1.535 0.386 0 CA-C-O 118.957 -0.544 . . . . 0.0 110.737 -176.237 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 75.4 Cg_endo -80.62 -29.74 2.17 Favored 'Trans proline' 0 N--CA 1.455 -0.775 0 C-N-CA 123.39 2.727 . . . . 0.0 111.872 179.313 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 14.6 m120 -58.66 -34.79 71.61 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 125.062 1.345 . . . . 0.0 113.001 -170.803 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 85.6 mt -55.21 135.06 49.92 Favored 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 173.974 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 30.2 p-10 -83.59 48.08 1.37 Allowed 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 123.768 0.827 . . . . 0.0 112.683 -169.894 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 5.6 tm-20 70.81 -64.02 0.39 Allowed 'General case' 0 C--N 1.342 0.28 0 C-N-CA 126.071 1.748 . . . . 0.0 112.201 177.456 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 24.9 pt-20 -54.61 -44.88 73.49 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.89 0.876 . . . . 0.0 112.182 -174.893 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 45.1 mt-30 -64.24 -52.2 59.92 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 123.295 0.638 . . . . 0.0 110.671 178.296 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 26.5 ttp-105 -52.29 -47.85 65.66 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 124.765 1.226 . . . . 0.0 111.354 178.726 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 4.8 m-80 -70.98 -40.29 71.98 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 123.607 0.763 . . . . 0.0 111.379 -178.847 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.89 -45.49 92.33 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.251 0.62 . . . . 0.0 111.065 177.413 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 8.3 mmmm -56.1 -58.5 7.65 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 123.684 0.794 . . . . 0.0 109.44 174.013 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 50.8 mt -55.02 -53.43 34.14 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.275 0 C-N-CA 124.392 1.077 . . . . 0.0 112.209 -175.246 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.65 -43.03 97.96 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 118.557 0.617 . . . . 0.0 111.147 -176.553 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 30.4 t -58.41 -50.95 71.86 Favored 'General case' 0 C--N 1.342 0.263 0 C-N-CA 123.448 0.699 . . . . 0.0 110.211 178.071 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 48.5 mt -55.1 -48.49 76.02 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.189 0 C-N-CA 125.228 1.411 . . . . 0.0 110.894 177.86 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -60.09 -50.78 72.34 Favored 'General case' 0 N--CA 1.455 -0.181 0 CA-C-O 119.187 -0.435 . . . . 0.0 111.208 179.902 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 2.8 p30 . . . . . 0 CA--C 1.536 0.406 0 N-CA-C 113.297 0.851 . . . . 0.0 113.297 -177.979 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 95.4 mt-30 . . . . . 0 N--CA 1.448 -0.525 0 N-CA-C 107.938 -1.134 . . . . 0.0 107.938 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 21.5 tp60 -116.44 -51.88 2.59 Favored 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 124.684 1.193 . . . . 0.0 108.514 174.129 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 13.8 tpt180 -65.31 -55.01 20.7 Favored 'General case' 0 C--N 1.34 0.189 0 C-N-CA 123.25 0.62 . . . . 0.0 109.84 174.032 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 81.5 mtp180 -52.66 -47.23 67.26 Favored 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 124.295 1.038 . . . . 0.0 110.521 178.382 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 8.7 t80 -61.48 -52.45 64.47 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 125.838 1.655 . . . . 0.0 112.095 179.362 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 91.1 t80 -58.26 -43.98 88.17 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 124.341 1.056 . . . . 0.0 110.631 178.54 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -63.78 -43.76 95.38 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.092 0.957 . . . . 0.0 110.849 177.92 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.49 -42.37 98.7 Favored 'General case' 0 C--N 1.341 0.225 0 C-N-CA 123.873 0.869 . . . . 0.0 111.188 176.766 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 58.4 tp -59.46 -51.59 69.23 Favored 'General case' 0 N--CA 1.454 -0.239 0 C-N-CA 123.414 0.685 . . . . 0.0 109.557 176.768 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 22.0 m-70 -93.84 49.52 1.35 Allowed 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 123.881 0.872 . . . . 0.0 110.774 -178.321 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -71.59 165.36 49.81 Favored Pre-proline 0 CA--C 1.539 0.543 0 CA-C-O 118.977 -0.535 . . . . 0.0 110.309 177.35 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -55.49 -65.82 0.1 Allowed 'Trans proline' 0 N--CA 1.457 -0.636 0 C-N-CA 123.148 2.565 . . . . 0.0 112.742 179.944 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 17.3 t-20 -167.73 70.32 0.09 Allowed 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 123.583 0.753 . . . . 0.0 109.762 -179.744 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -79.91 163.8 24.04 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 172.469 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 50.7 p-10 -79.87 17.87 0.89 Allowed 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 114.328 1.233 . . . . 0.0 114.328 -169.967 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 13.5 tp10 71.58 -44.92 0.6 Allowed 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 126.17 1.788 . . . . 0.0 113.187 -176.423 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 14.7 tp10 -57.22 -51.46 69.25 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 119.09 0.859 . . . . 0.0 110.638 178.072 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 45.7 mt-30 -62.15 -46.28 89.66 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 124.041 0.936 . . . . 0.0 111.151 178.883 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 45.9 ttm180 -55.42 -51.29 67.35 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 124.607 1.163 . . . . 0.0 110.402 178.455 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 47.6 t30 -61.5 -51.14 69.88 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 124.52 1.128 . . . . 0.0 110.396 179.54 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -54.51 -45.89 73.39 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 124.091 0.957 . . . . 0.0 111.743 -179.647 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 54.6 mmtt -55.62 -53.33 57.82 Favored 'General case' 0 C--N 1.34 0.169 0 C-N-CA 123.095 0.558 . . . . 0.0 110.214 173.06 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 89.9 mt -60.64 -35.21 62.19 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 C-N-CA 123.155 0.582 . . . . 0.0 111.866 -176.263 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 64.1 mttm -63.04 -48.41 78.81 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 119.162 0.892 . . . . 0.0 110.07 170.556 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 15.0 m -74.59 3.28 8.01 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 124.432 1.093 . . . . 0.0 113.459 -178.606 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 57.5 mt -107.85 -61.5 2.48 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.237 0 N-CA-C 106.867 -1.531 . . . . 0.0 106.867 171.543 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 19.7 tpp180 -81.4 68.96 7.93 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 125.187 1.395 . . . . 0.0 108.843 174.948 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 . . . . . 0 CA--C 1.531 0.236 0 N-CA-C 108.501 -0.925 . . . . 0.0 108.501 174.814 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 36.0 tt0 . . . . . 0 N--CA 1.456 -0.152 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 67.6 mt-30 -46.29 -33.8 4.02 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 125.861 1.664 . . . . 0.0 113.124 -169.957 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 44.8 mtt180 -56.34 -72.86 0.07 Allowed 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.446 1.098 . . . . 0.0 111.416 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -64.39 -38.38 90.82 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 124.284 1.033 . . . . 0.0 110.923 -178.743 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 49.2 t80 -59.43 -53.31 59.61 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 126.23 1.812 . . . . 0.0 110.966 -177.594 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 47.7 t80 -62.49 -45.04 94.82 Favored 'General case' 0 C--N 1.341 0.227 0 C-N-CA 123.562 0.745 . . . . 0.0 110.284 175.794 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 15.8 tp10 -55.74 -49.39 73.21 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 122.549 0.339 . . . . 0.0 110.866 -179.097 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.24 -51.46 68.85 Favored 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 123.8 0.84 . . . . 0.0 111.165 179.083 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 57.7 tp -60.65 -57.75 11.38 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 123.915 0.886 . . . . 0.0 111.2 -176.905 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 29.0 m-70 -83.41 61.81 6.39 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 124.738 1.215 . . . . 0.0 109.765 -178.659 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -158.6 120.27 1.93 Allowed Pre-proline 0 CA--C 1.533 0.326 0 C-N-CA 123.911 0.884 . . . . 0.0 109.061 177.69 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -77.9 -27.65 5.68 Favored 'Trans proline' 0 N--CA 1.455 -0.736 0 C-N-CA 123.316 2.677 . . . . 0.0 112.01 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -54.71 -53.68 51.8 Favored 'General case' 0 C--N 1.344 0.341 0 C-N-CA 123.711 0.804 . . . . 0.0 110.218 -179.335 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 81.1 mt -71.03 121.53 18.38 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 107.146 -1.428 . . . . 0.0 107.146 169.625 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 25.3 p30 -72.57 175.54 6.24 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-O 120.749 0.309 . . . . 0.0 110.742 -177.747 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -59.2 -51.39 70.18 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 123.186 0.594 . . . . 0.0 111.972 -171.729 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -62.77 -38.53 90.99 Favored 'General case' 0 CA--C 1.534 0.34 0 N-CA-C 111.867 0.321 . . . . 0.0 111.867 -179.551 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 85.5 mt-30 -62.28 -56.46 18.29 Favored 'General case' 0 C--N 1.34 0.163 0 C-N-CA 123.496 0.718 . . . . 0.0 110.823 178.523 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 31.6 ptt180 -66.29 -32.11 73.33 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 112.098 0.407 . . . . 0.0 112.098 -177.578 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 72.6 m-20 -64.93 -40.01 94.38 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 118.226 0.466 . . . . 0.0 110.864 172.224 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -63.38 -44.4 94.83 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 118.057 0.39 . . . . 0.0 110.669 175.953 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 11.9 mmmm -55.41 -51.49 66.69 Favored 'General case' 0 C--N 1.341 0.223 0 C-N-CA 123.237 0.615 . . . . 0.0 110.439 174.642 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 33.9 mt -51.74 -53.28 17.7 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.189 0 C-N-CA 123.404 0.682 . . . . 0.0 110.327 175.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 82.2 tttt -65.01 -25.84 68.03 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.039 0.535 . . . . 0.0 112.316 -177.359 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 49.5 m -74.34 -46.96 37.37 Favored 'General case' 0 CA--C 1.529 0.16 0 CA-C-N 118.691 0.678 . . . . 0.0 110.716 175.727 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 40.8 mt -63.72 -62.13 1.35 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.261 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 179.197 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 52.1 ttp85 -78.88 75.89 5.38 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 125.335 1.454 . . . . 0.0 107.72 170.09 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 . . . . . 0 CA--C 1.534 0.333 0 C-N-CA 127.336 2.254 . . . . 0.0 112.529 -178.129 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.4 mp0 . . . . . 0 CA--C 1.533 0.312 0 CA-C-O 119.845 -0.121 . . . . 0.0 111.314 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 22.6 tt0 -54.33 -43.25 71.05 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 125.188 1.395 . . . . 0.0 111.635 176.473 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.48 -58.45 7.97 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 124.157 0.983 . . . . 0.0 109.488 177.226 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -61.39 -38.45 87.07 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-O 118.932 -0.556 . . . . 0.0 111.917 -178.933 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 25.1 m-85 -61.49 -43.79 98.24 Favored 'General case' 0 C--N 1.342 0.241 0 CA-C-N 118.999 0.818 . . . . 0.0 110.917 177.733 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 53.5 t80 -60.16 -46.74 88.64 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 118.082 0.401 . . . . 0.0 110.094 175.112 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 15.5 tp10 -56.38 -45.15 80.67 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 117.95 0.341 . . . . 0.0 110.876 177.934 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.15 -53.73 48.79 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 124.341 1.056 . . . . 0.0 111.336 -178.677 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 58.7 mt -61.95 -54.27 44.14 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 123.5 0.72 . . . . 0.0 110.575 -178.686 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 29.0 m-70 -85.1 66.21 9.63 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.265 1.026 . . . . 0.0 109.276 -177.82 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -127.46 140.34 37.72 Favored Pre-proline 0 CA--C 1.536 0.409 0 C-N-CA 125.743 1.617 . . . . 0.0 108.531 -178.544 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -76.89 -38.73 0.78 Allowed 'Trans proline' 0 N--CA 1.457 -0.636 0 C-N-CA 123.085 2.523 . . . . 0.0 112.841 -178.872 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 35.3 m120 -81.16 74.04 8.18 Favored 'General case' 0 C--N 1.34 0.185 0 C-N-CA 124.262 1.025 . . . . 0.0 110.498 -173.547 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 33.2 mt -98.86 140.14 33.48 Favored 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 112.937 0.717 . . . . 0.0 112.937 -174.762 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 52.1 p-10 -153.79 12.53 0.45 Allowed 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 126.561 1.944 . . . . 0.0 110.197 169.683 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 18.7 tp10 67.02 -47.5 0.47 Allowed 'General case' 0 C--N 1.346 0.449 0 C-N-CA 128.105 2.562 . . . . 0.0 113.177 -171.176 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 5.2 tm-20 -49.05 -45.21 42.52 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 124.789 1.235 . . . . 0.0 111.882 177.637 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 49.4 mm-40 -65.09 -41.54 94.88 Favored 'General case' 0 C--N 1.34 0.192 0 N-CA-C 109.902 -0.407 . . . . 0.0 109.902 -179.438 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 4.4 mmp_? -59.68 -61.85 2.31 Favored 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 177.492 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 17.4 t-20 -45.96 -50.18 15.04 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 126.128 1.771 . . . . 0.0 111.947 -177.878 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -55.7 -44.99 77.91 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 124.182 0.993 . . . . 0.0 111.595 176.259 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 26.1 mtpp -69.4 -42.08 75.56 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-O 118.432 -0.794 . . . . 0.0 111.777 179.635 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 10.3 mm -54.67 -53.97 27.13 Favored 'Isoleucine or valine' 0 C--N 1.345 0.377 0 CA-C-N 119.452 1.024 . . . . 0.0 110.144 -176.385 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 9.8 ptpp? -59.06 -41.41 87.85 Favored 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 111.889 0.329 . . . . 0.0 111.889 -178.579 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 37.6 m -60.49 -44.33 96.06 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 123.011 0.524 . . . . 0.0 111.117 177.559 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 63.1 mt -63.89 -42.55 96.18 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 C-N-CA 123.892 0.877 . . . . 0.0 110.24 179.109 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 34.3 mmt180 -58.89 -39.58 81.87 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 122.98 0.512 . . . . 0.0 110.65 175.608 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 65.9 m-20 . . . . . 0 CA--C 1.532 0.278 0 C-N-CA 122.738 0.415 . . . . 0.0 111.286 178.548 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.3 tp-100 . . . . . 0 CA--C 1.531 0.238 0 N-CA-C 110.905 -0.035 . . . . 0.0 110.905 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 29.1 mm100 -60.86 -36.09 78.28 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-O 118.995 -0.526 . . . . 0.0 111.463 175.519 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.81 -39.46 83.98 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 118.473 0.579 . . . . 0.0 111.251 176.115 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 74.5 mtt85 -61.18 -46.71 89.38 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 118.42 0.554 . . . . 0.0 110.308 175.449 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 21.7 m-85 -61.14 -46.76 89.22 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 122.659 0.384 . . . . 0.0 111.261 175.855 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 52.8 t80 -54.81 -49.92 69.81 Favored 'General case' 0 C--O 1.225 -0.208 0 C-N-CA 124.034 0.933 . . . . 0.0 110.32 179.741 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -57.59 -52.81 63.9 Favored 'General case' 0 CA--C 1.531 0.229 0 N-CA-C 109.712 -0.477 . . . . 0.0 109.712 174.704 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -70.27 9.67 0.56 Allowed 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.885 1.274 . . . . 0.0 114.12 -179.987 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 64.6 tp -123.25 -37.48 2.69 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.457 1.103 . . . . 0.0 110.971 172.672 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 17.2 m-70 -90.95 -28.68 17.9 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.871 1.268 . . . . 0.0 113.464 -174.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -51.07 136.67 28.22 Favored Pre-proline 0 CA--C 1.543 0.687 0 C-N-CA 124.264 1.026 . . . . 0.0 112.297 -174.661 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_exo -45.53 -46.52 14.52 Favored 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 124.541 3.494 . . . . 0.0 115.777 -179.807 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 3.6 t30 -67.38 120.53 14.02 Favored 'General case' 0 C--N 1.34 0.172 0 N-CA-C 109.678 -0.49 . . . . 0.0 109.678 -177.699 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -156.04 130.28 8.76 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 122.86 0.464 . . . . 0.0 111.083 -173.911 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 1.8 p-10 -157.58 33.67 0.27 Allowed 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.11 0.964 . . . . 0.0 111.142 170.043 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.8 tm-20 72.33 -57.39 0.62 Allowed 'General case' 0 C--N 1.346 0.427 0 C-N-CA 127.054 2.142 . . . . 0.0 113.499 174.668 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 6.6 tm-20 -54.64 -49.53 70.34 Favored 'General case' 0 CA--C 1.529 0.158 0 C-N-CA 124.649 1.18 . . . . 0.0 110.416 -177.081 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 13.4 mm100 -56.27 -49.88 72.94 Favored 'General case' 0 C--N 1.341 0.233 0 C-N-CA 123.259 0.623 . . . . 0.0 109.764 -178.231 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 5.3 mpt_? -51.44 -73.82 0.04 OUTLIER 'General case' 0 CA--C 1.515 -0.385 0 C-N-CA 125.12 1.368 . . . . 0.0 110.745 178.023 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 18.3 m-80 -54.24 -38.15 65.42 Favored 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 111.914 0.339 . . . . 0.0 111.914 -170.787 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -61.16 -58.14 9.58 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 123.071 0.549 . . . . 0.0 111.812 175.933 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 14.8 ptpt -67.83 -44.23 77.72 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 118.008 0.367 . . . . 0.0 111.132 -174.679 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 6.3 mm -48.05 -52.04 8.01 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.16 0 C-N-CA 125.686 1.595 . . . . 0.0 109.962 174.148 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 23.0 ttmm -60.91 -48.95 79.44 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 123.804 0.842 . . . . 0.0 111.248 -178.763 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 83.7 p -62.79 -40.88 98.69 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 122.553 0.341 . . . . 0.0 111.849 -178.176 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 61.3 mt -63.3 -44.13 98.98 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.321 0 C-N-CA 124.075 0.95 . . . . 0.0 109.057 175.021 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 33.2 ttm180 -80.88 55.01 2.31 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 125.176 1.391 . . . . 0.0 110.478 179.447 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 23.3 t70 . . . . . 0 CA--C 1.529 0.135 0 C-N-CA 125.58 1.552 . . . . 0.0 108.666 175.341 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 72.7 mt-30 . . . . . 0 CA--C 1.528 0.125 0 N-CA-C 111.97 0.359 . . . . 0.0 111.97 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -52.72 -48.97 66.3 Favored 'General case' 0 N--CA 1.456 -0.17 0 C-N-CA 123.058 0.543 . . . . 0.0 109.666 171.582 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 16.2 mmm-85 -67.91 -34.28 76.32 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-O 118.47 -0.776 . . . . 0.0 112.88 175.907 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 28.4 mmt85 -56.58 -51.7 67.64 Favored 'General case' 0 C--N 1.341 0.236 0 CA-C-N 119.175 0.898 . . . . 0.0 109.705 175.166 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 11.0 m-85 -56.47 -52.19 65.62 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 123.814 0.845 . . . . 0.0 110.918 173.419 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 31.6 t80 -78.97 60.91 3.03 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.485 1.114 . . . . 0.0 109.883 -179.529 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 178.94 -55.03 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 127.339 2.256 . . . . 0.0 107.362 -174.724 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.37 -44.99 96.23 Favored 'General case' 0 C--N 1.34 0.181 0 C-N-CA 124.899 1.279 . . . . 0.0 110.565 175.232 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 89.4 mt -58.33 -47.43 83.76 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 123.118 0.567 . . . . 0.0 109.844 172.343 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 22.5 m-70 -86.37 54.96 3.34 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 124.412 1.085 . . . . 0.0 110.331 -176.535 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 10.6 t0 -124.99 85.18 58.14 Favored Pre-proline 0 CA--C 1.535 0.373 0 C-N-CA 124.425 1.09 . . . . 0.0 109.382 -175.93 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -82.14 59.4 7.02 Favored 'Trans proline' 0 N--CA 1.456 -0.71 0 C-N-CA 123.856 3.037 . . . . 0.0 109.887 179.626 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -155.72 -58.62 0.1 Allowed 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 124.586 1.154 . . . . 0.0 108.981 179.286 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 91.2 mt -70.78 144.16 50.96 Favored 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 174.699 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 29.8 p-10 -79.51 174.66 11.35 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-O 121.195 0.521 . . . . 0.0 110.867 179.943 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 35.8 tp10 -60.88 -36.75 80.02 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 123.772 0.829 . . . . 0.0 111.592 -176.995 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 51.9 mt-10 -59.76 -57.51 12.59 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 123.322 0.649 . . . . 0.0 110.735 179.728 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 37.3 mt-30 -59.59 -47.76 84.31 Favored 'General case' 0 CA--C 1.529 0.148 0 C-N-CA 124.042 0.937 . . . . 0.0 110.787 -178.995 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 12.1 ttp-105 -52.83 -55.13 25.28 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 124.716 1.206 . . . . 0.0 111.046 176.972 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 6.5 m120 -59.95 -44.91 94.11 Favored 'General case' 0 CA--C 1.529 0.156 0 C-N-CA 122.693 0.397 . . . . 0.0 110.858 179.324 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.19 -51.08 69.34 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 123.991 0.916 . . . . 0.0 111.744 -177.768 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 19.7 ptpt -65.09 -41.41 95.02 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 118.113 0.415 . . . . 0.0 111.302 179.499 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 5.7 mt -60.39 -52.27 63.33 Favored 'Isoleucine or valine' 0 C--N 1.34 0.171 0 CA-C-O 118.755 -0.64 . . . . 0.0 111.176 -179.452 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 15.0 ptmm? -62.09 -37.67 85.95 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 118.856 0.753 . . . . 0.0 111.591 -178.783 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 55.7 m -61.24 -50.51 72.76 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 122.9 0.48 . . . . 0.0 111.014 177.531 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 89.3 mt -60.88 -51.71 70.02 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 C-N-CA 123.89 0.876 . . . . 0.0 110.195 179.194 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 37.7 ttm180 -60.24 -36.29 77.42 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 124.846 1.258 . . . . 0.0 111.624 -177.172 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 35.9 t70 . . . . . 0 N--CA 1.453 -0.284 0 C-N-CA 123.729 0.812 . . . . 0.0 109.293 173.391 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 63.6 tt0 . . . . . 0 N--CA 1.453 -0.314 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -57.75 -38.06 74.73 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.868 1.267 . . . . 0.0 111.617 174.487 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 40.6 tpt85 -67.65 -51.81 45.55 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 123.715 0.806 . . . . 0.0 110.631 -178.768 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 78.2 ttt-85 -57.74 -51.71 68.44 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 125.586 1.554 . . . . 0.0 110.645 176.793 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 13.1 t80 -47.14 -59.74 2.94 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 126.243 1.817 . . . . 0.0 111.513 173.508 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 50.9 t80 -56.09 -49.18 74.56 Favored 'General case' 0 N--CA 1.456 -0.141 0 C-N-CA 124.128 0.971 . . . . 0.0 110.843 -179.42 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -56.77 -54.52 45.31 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 123.442 0.697 . . . . 0.0 110.748 -177.822 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.21 -44.52 97.15 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 123.658 0.783 . . . . 0.0 111.944 -178.349 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 59.8 tp -61.36 -53.2 59.75 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 124.23 1.012 . . . . 0.0 110.993 -179.621 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 19.4 m-70 -76.62 -50.98 12.46 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 123.593 0.757 . . . . 0.0 111.951 -173.694 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 9.5 t0 -67.23 124.29 88.6 Favored Pre-proline 0 CA--C 1.535 0.389 0 CA-C-O 118.87 -0.586 . . . . 0.0 109.668 -174.84 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_endo -76.15 -10.03 19.3 Favored 'Trans proline' 0 N--CA 1.456 -0.707 0 C-N-CA 123.412 2.741 . . . . 0.0 114.355 -171.937 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -62.56 -31.84 72.7 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 114.382 1.253 . . . . 0.0 114.382 -169.981 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 10.6 mp -63.67 146.63 53.44 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 118.555 0.616 . . . . 0.0 110.073 177.153 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 44.0 p-10 -84.62 29.35 0.61 Allowed 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 114.451 1.278 . . . . 0.0 114.451 -169.71 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 76.34 -58.37 0.53 Allowed 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 124.852 1.261 . . . . 0.0 111.384 -174.878 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 5.6 mp0 -56.88 -49.95 73.98 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 123.385 0.674 . . . . 0.0 110.663 -178.732 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 59.7 mt-30 -51.61 -60.0 3.65 Favored 'General case' 0 C--N 1.34 0.17 0 C-N-CA 124.44 1.096 . . . . 0.0 111.084 178.423 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 10.7 ptp85 -63.42 -44.97 93.08 Favored 'General case' 0 C--N 1.342 0.251 0 CA-C-O 119.253 -0.403 . . . . 0.0 110.75 -175.883 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -55.23 -51.86 65.23 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 123.748 0.819 . . . . 0.0 111.094 -178.132 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -53.78 -53.52 51.15 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 123.641 0.777 . . . . 0.0 111.485 -178.475 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 19.9 ptpt -69.8 -36.94 76.08 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-O 118.648 -0.691 . . . . 0.0 112.007 -178.704 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 44.4 mt -59.44 -45.3 93.73 Favored 'Isoleucine or valine' 0 C--N 1.34 0.189 0 CA-C-N 119.1 0.864 . . . . 0.0 110.162 178.855 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 44.2 mmtm -59.29 -43.27 92.57 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 122.49 0.316 . . . . 0.0 110.496 175.639 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 16.0 m -63.75 -42.21 97.89 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.281 0.632 . . . . 0.0 111.714 179.104 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 30.5 mt -61.56 -49.41 84.51 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.195 0 C-N-CA 125.128 1.371 . . . . 0.0 109.228 176.884 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -82.87 51.47 1.92 Allowed 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 124.714 1.206 . . . . 0.0 110.57 -179.679 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 3.9 p30 . . . . . 0 CA--C 1.531 0.233 0 C-N-CA 123.299 0.64 . . . . 0.0 109.792 171.431 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 21.4 tt0 . . . . . 0 CA--C 1.53 0.199 0 N-CA-C 110.221 -0.289 . . . . 0.0 110.221 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 20.1 tt0 -53.81 -37.02 63.11 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 125.286 1.434 . . . . 0.0 111.508 176.47 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 13.4 mmp_? -70.78 -51.29 27.92 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 118.883 0.765 . . . . 0.0 111.64 178.832 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.42 -50.38 67.73 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 118.897 0.772 . . . . 0.0 109.996 176.973 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 78.1 t80 -50.32 -55.88 13.63 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 126.941 2.096 . . . . 0.0 112.081 174.172 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 49.4 t80 -58.82 -48.66 80.52 Favored 'General case' 0 C--N 1.339 0.14 0 C-N-CA 124.6 1.16 . . . . 0.0 110.927 -178.298 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -54.91 -54.67 39.64 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 123.494 0.717 . . . . 0.0 109.806 178.985 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -56.68 -49.08 76.16 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 122.616 0.366 . . . . 0.0 111.904 -179.671 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 54.4 tp -58.43 -53.67 55.68 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 124.084 0.954 . . . . 0.0 111.333 -178.837 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 19.4 m-70 -77.39 -45.77 24.86 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.783 0.833 . . . . 0.0 112.648 -171.489 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 80.0 m-20 -62.9 130.7 94.19 Favored Pre-proline 0 CA--C 1.537 0.456 0 CA-C-N 118.215 0.462 . . . . 0.0 110.647 -171.254 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -70.77 -29.28 19.3 Favored 'Trans proline' 0 N--CA 1.457 -0.634 0 C-N-CA 123.973 3.115 . . . . 0.0 113.562 -169.755 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 9.8 p-10 -58.76 -27.99 65.48 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 118.493 0.588 . . . . 0.0 111.796 -179.863 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -84.08 72.13 10.5 Favored 'General case' 0 C--N 1.342 0.273 0 N-CA-C 106.112 -1.81 . . . . 0.0 106.112 169.442 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 -77.29 58.09 1.58 Allowed 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 125.612 1.565 . . . . 0.0 112.687 -169.997 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 22.6 tt0 70.76 157.59 0.17 Allowed 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 125.239 1.416 . . . . 0.0 110.63 -176.919 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.3 tp10 73.8 -56.13 0.65 Allowed 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 127.027 2.131 . . . . 0.0 110.811 -175.392 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 50.9 mt-30 -54.86 -61.59 2.21 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 125.31 1.444 . . . . 0.0 110.01 175.632 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 19.4 ptt180 -63.23 -38.88 92.92 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 123.599 0.76 . . . . 0.0 111.76 178.861 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 14.4 m120 -61.0 -45.02 96.5 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 118.387 0.539 . . . . 0.0 111.099 179.924 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -60.12 -47.54 85.48 Favored 'General case' 0 CA--C 1.529 0.165 0 C-N-CA 123.564 0.745 . . . . 0.0 110.439 176.639 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 30.6 tttt -55.32 -51.17 67.59 Favored 'General case' 0 N--CA 1.448 -0.541 0 C-N-CA 123.441 0.697 . . . . 0.0 111.396 175.748 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 58.2 mt -58.39 -44.73 89.2 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.205 0 C-N-CA 124.269 1.028 . . . . 0.0 110.293 -179.361 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 27.2 ttpp -58.77 -46.95 86.32 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 123.488 0.715 . . . . 0.0 111.251 177.071 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 88.9 p -68.22 -37.87 81.3 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 118.438 0.563 . . . . 0.0 111.94 -179.705 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 68.8 mt -64.82 -60.7 2.34 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.188 0 C-N-CA 123.907 0.883 . . . . 0.0 110.149 179.238 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 17.7 ptp180 -133.66 70.38 1.46 Allowed 'General case' 0 N--CA 1.456 -0.133 0 C-N-CA 123.99 0.916 . . . . 0.0 109.734 -173.215 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 25.3 t70 . . . . . 0 CA--C 1.531 0.221 0 C-N-CA 124.363 1.065 . . . . 0.0 111.556 177.968 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.54 0.582 0 CA-C-O 121.941 0.877 . . . . 0.0 109.969 . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? -165.17 -52.78 0.03 OUTLIER 'General case' 0 CA--C 1.523 -0.075 0 C-N-CA 126.777 2.031 . . . . 0.0 106.465 -178.947 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 6.1 tmm_? -50.78 -48.56 59.35 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 125.435 1.494 . . . . 0.0 109.874 171.961 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 19.2 ptp180 -63.87 -45.24 90.34 Favored 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 112.582 0.586 . . . . 0.0 112.582 -179.01 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 60.8 m-85 -64.11 -47.42 80.07 Favored 'General case' 0 C--N 1.339 0.139 0 C-N-CA 122.66 0.384 . . . . 0.0 110.386 -179.66 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 64.1 t80 -56.64 -46.82 80.77 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 123.902 0.881 . . . . 0.0 110.495 175.236 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 12.9 tp10 -58.77 -58.47 8.46 Favored 'General case' 0 N--CA 1.455 -0.225 0 C-N-CA 122.949 0.5 . . . . 0.0 110.027 -179.228 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -52.93 -47.24 68.17 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 124.648 1.179 . . . . 0.0 111.588 -179.982 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 63.7 tp -60.14 -49.93 75.69 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.095 0.958 . . . . 0.0 110.612 178.221 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 17.1 m-70 -85.46 54.76 3.23 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.135 0.974 . . . . 0.0 110.453 -178.996 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 73.7 m-20 -135.29 83.49 38.16 Favored Pre-proline 0 CA--C 1.532 0.288 0 C-N-CA 124.698 1.199 . . . . 0.0 108.68 171.482 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_exo -51.99 -42.93 55.72 Favored 'Trans proline' 0 N--CA 1.459 -0.517 0 C-N-CA 124.118 3.212 . . . . 0.0 113.167 175.721 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 50.3 t30 -55.29 -46.66 76.2 Favored 'General case' 0 C--N 1.341 0.21 0 C-N-CA 124.6 1.16 . . . . 0.0 111.651 -178.611 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -73.04 108.81 6.14 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 106.734 -1.58 . . . . 0.0 106.734 173.346 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 1.9 p30 -64.79 170.14 4.47 Favored 'General case' 0 CA--C 1.531 0.218 0 N-CA-C 111.538 0.199 . . . . 0.0 111.538 -172.389 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -47.05 -41.73 17.27 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 124.659 1.184 . . . . 0.0 112.683 -177.093 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 14.3 tp10 -60.83 -58.47 8.31 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 118.354 0.525 . . . . 0.0 110.976 179.503 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 71.9 mt-30 -58.15 -50.55 73.11 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 124.211 1.004 . . . . 0.0 110.806 -178.507 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 17.9 ttp180 -56.83 -55.17 37.83 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 125.594 1.558 . . . . 0.0 110.999 -179.813 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 -60.04 -42.2 93.92 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 122.806 0.443 . . . . 0.0 111.109 179.474 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.96 -43.34 91.27 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 123.196 0.599 . . . . 0.0 111.167 177.509 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 25.8 mmtp -58.5 -58.46 8.42 Favored 'General case' 0 C--N 1.341 0.229 0 C-N-CA 122.875 0.47 . . . . 0.0 110.181 174.883 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 30.3 mm -48.87 -51.77 11.32 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 C-N-CA 123.623 0.769 . . . . 0.0 110.724 -179.522 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 66.0 tttp -61.41 -54.85 38.21 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 124.303 1.041 . . . . 0.0 111.221 -178.168 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 85.6 p -59.3 -38.67 80.81 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 123.261 0.625 . . . . 0.0 112.141 -175.593 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 71.6 mt -61.04 -55.07 27.19 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 C-N-CA 123.578 0.751 . . . . 0.0 110.442 -179.502 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 19.5 ptp180 -72.05 -49.51 36.08 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 118.155 0.434 . . . . 0.0 111.447 -178.225 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 31.9 t70 . . . . . 0 CA--C 1.53 0.193 0 C-N-CA 124.697 1.199 . . . . 0.0 108.631 177.979 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 20.3 tt0 . . . . . 0 CA--C 1.534 0.333 0 N-CA-C 110.775 -0.083 . . . . 0.0 110.775 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 18.4 tt0 -54.4 -29.76 50.03 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 126.204 1.801 . . . . 0.0 112.021 175.042 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 21.0 mmt85 -70.71 -57.54 4.57 Favored 'General case' 0 C--N 1.341 0.2 0 CA-C-N 118.972 0.806 . . . . 0.0 109.397 177.668 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 79.7 mtt85 -50.58 -47.67 57.86 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 124.215 1.006 . . . . 0.0 110.632 177.76 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 31.2 t80 -48.68 -51.35 28.97 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 126.423 1.889 . . . . 0.0 111.287 173.891 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 18.2 m-30 -68.0 -35.67 78.72 Favored 'General case' 0 C--O 1.225 -0.218 0 C-N-CA 123.233 0.613 . . . . 0.0 111.649 179.142 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -60.55 -25.23 66.0 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 119.803 1.183 . . . . 0.0 111.64 175.813 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -84.45 -49.79 8.34 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 123.234 0.614 . . . . 0.0 111.497 171.727 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 34.4 tp -82.42 -57.47 3.34 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.065 0.946 . . . . 0.0 111.413 -170.295 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 25.0 m170 -77.68 69.63 3.95 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 125.404 1.482 . . . . 0.0 108.778 177.727 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -158.45 158.38 29.56 Favored Pre-proline 0 CA--C 1.534 0.333 0 C-N-CA 124.666 1.186 . . . . 0.0 107.866 -172.157 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -67.5 42.2 0.21 Allowed 'Trans proline' 0 CA--C 1.544 1.01 0 C-N-CA 123.737 2.958 . . . . 0.0 114.219 169.767 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 14.9 t-20 61.16 92.89 0.05 OUTLIER 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 126.955 2.102 . . . . 0.0 112.578 177.777 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 78.2 mt -64.51 162.32 15.59 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 169.729 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 10.0 p30 -54.63 144.41 21.87 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 123.088 0.555 . . . . 0.0 110.646 178.182 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 15.3 mp0 -52.45 -42.18 63.94 Favored 'General case' 0 C--O 1.226 -0.143 0 C-N-CA 124.411 1.084 . . . . 0.0 112.013 -173.932 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.4 tm-20 -56.43 -61.73 2.21 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 122.915 0.486 . . . . 0.0 110.551 -177.757 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 26.9 mm100 -61.2 -51.95 66.86 Favored 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 123.135 0.574 . . . . 0.0 110.916 179.197 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 32.2 ttp-105 -57.19 -61.98 2.08 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 123.693 0.797 . . . . 0.0 110.706 -174.142 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 14.4 t-20 -59.39 -39.7 84.19 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 123.974 0.91 . . . . 0.0 111.174 -175.548 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -57.15 -51.27 70.0 Favored 'General case' 0 C--N 1.342 0.257 0 C-N-CA 122.695 0.398 . . . . 0.0 110.83 176.447 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 59.8 mtpt -59.3 -54.84 42.16 Favored 'General case' 0 C--N 1.341 0.238 0 C-N-CA 123.081 0.552 . . . . 0.0 110.59 177.381 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 14.6 mm -51.14 -49.73 28.0 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.276 0 C-N-CA 124.207 1.003 . . . . 0.0 110.682 -178.384 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 27.7 tptp -73.07 -42.21 63.3 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 123.216 0.606 . . . . 0.0 111.973 -175.445 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 99.1 p -61.97 -34.39 76.05 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 118.647 0.658 . . . . 0.0 111.015 178.873 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 90.7 mt -73.11 -49.47 38.28 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.255 0 C-N-CA 124.518 1.127 . . . . 0.0 109.596 175.682 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 81.5 mtp180 -89.77 61.78 5.52 Favored 'General case' 0 CA--C 1.529 0.165 0 C-N-CA 124.228 1.011 . . . . 0.0 108.822 176.542 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 30.2 t0 . . . . . 0 N--CA 1.453 -0.288 0 C-N-CA 123.817 0.847 . . . . 0.0 109.387 -176.318 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 20.2 mt-30 . . . . . 0 N--CA 1.449 -0.504 0 N-CA-C 107.394 -1.336 . . . . 0.0 107.394 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 17.8 tp60 -149.51 -51.21 0.15 Allowed 'General case' 0 CA--C 1.532 0.25 0 CA-C-O 118.923 -0.561 . . . . 0.0 111.834 -176.663 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -70.11 -79.59 0.06 Allowed 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 118.851 0.751 . . . . 0.0 110.557 -172.874 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -55.88 -26.2 46.01 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 124.522 1.129 . . . . 0.0 112.243 173.688 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 62.2 t80 -67.75 -49.43 62.57 Favored 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 125.202 1.401 . . . . 0.0 110.973 178.94 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 70.4 t80 -58.08 -41.15 82.82 Favored 'General case' 0 C--N 1.34 0.19 0 CA-C-O 119.194 -0.431 . . . . 0.0 110.128 174.31 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 15.3 tp10 -59.23 -57.97 10.67 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 118.356 0.525 . . . . 0.0 110.042 176.68 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -52.68 -46.46 67.27 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 124.672 1.189 . . . . 0.0 112.359 -178.245 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 73.0 mt -62.75 -62.14 1.93 Allowed 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.211 0.604 . . . . 0.0 109.775 175.776 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 19.6 m-70 -84.97 48.82 1.62 Allowed 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.53 1.132 . . . . 0.0 110.711 -177.095 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -77.73 162.13 69.16 Favored Pre-proline 0 CA--C 1.538 0.488 0 N-CA-C 108.394 -0.965 . . . . 0.0 108.394 173.711 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -79.13 65.2 8.88 Favored 'Trans proline' 0 N--CA 1.454 -0.842 0 C-N-CA 124.243 3.295 . . . . 0.0 109.861 179.704 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 31.0 m120 59.25 67.78 0.87 Allowed 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 126.792 2.037 . . . . 0.0 112.768 169.97 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 82.0 mt -67.92 166.42 15.71 Favored 'General case' 0 CA--C 1.532 0.283 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 169.72 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 48.7 p-10 -75.9 26.35 0.11 Allowed 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.851 1.26 . . . . 0.0 113.91 -174.54 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 73.01 -55.61 0.68 Allowed 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 126.03 1.732 . . . . 0.0 111.689 -174.954 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -53.83 -54.53 37.12 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 125.094 1.358 . . . . 0.0 111.303 -177.567 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 42.7 mt-30 -61.22 -45.31 95.09 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 123.686 0.794 . . . . 0.0 111.128 -178.813 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 37.6 ttm105 -56.98 -55.85 29.32 Favored 'General case' 0 C--N 1.34 0.196 0 C-N-CA 122.845 0.458 . . . . 0.0 110.118 177.394 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 47.9 m-20 -54.35 -45.19 72.68 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 123.994 0.918 . . . . 0.0 111.052 -179.865 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.43 -43.97 88.94 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 123.351 0.66 . . . . 0.0 111.302 177.165 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 61.2 mtpt -62.06 -45.15 94.79 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-O 119.079 -0.486 . . . . 0.0 110.91 176.986 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 45.2 mm -57.98 -47.34 86.85 Favored 'Isoleucine or valine' 0 C--N 1.342 0.259 0 CA-C-N 118.851 0.751 . . . . 0.0 110.328 176.183 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 63.0 mttp -58.75 -39.16 80.13 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 123.035 0.534 . . . . 0.0 111.563 177.52 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 40.4 m -63.72 -46.42 85.5 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 122.853 0.461 . . . . 0.0 110.946 177.189 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 74.1 mt -63.14 -42.16 95.52 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 C-N-CA 123.567 0.747 . . . . 0.0 110.2 178.892 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 1.5 mmp_? -59.33 -52.24 66.49 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 124.043 0.937 . . . . 0.0 110.035 176.611 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 37.2 t70 . . . . . 0 CA--C 1.531 0.246 0 C-N-CA 124.361 1.064 . . . . 0.0 109.595 179.535 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 18.7 tp60 . . . . . 0 N--CA 1.455 -0.186 0 CA-C-O 119.007 -0.52 . . . . 0.0 110.701 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 22.6 pt20 -50.48 -35.93 31.35 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.394 1.077 . . . . 0.0 112.653 178.166 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 19.5 tpp85 -71.74 -49.42 39.31 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 124.16 0.984 . . . . 0.0 111.312 -179.522 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 38.6 mtp180 -58.94 -47.49 84.87 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 124.277 1.031 . . . . 0.0 110.078 177.125 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 36.3 t80 -53.25 -55.81 21.55 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 126.694 1.998 . . . . 0.0 110.812 174.577 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 44.7 t80 -54.15 -49.29 69.58 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 123.952 0.901 . . . . 0.0 110.682 177.132 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -56.99 -50.68 71.95 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 123.885 0.874 . . . . 0.0 110.937 -177.404 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.71 -53.03 53.65 Favored 'General case' 0 C--N 1.34 0.17 0 CA-C-O 119.413 -0.327 . . . . 0.0 110.781 178.911 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 9.2 tt -51.13 -45.12 61.52 Favored 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 125.46 1.504 . . . . 0.0 111.175 -178.087 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 15.4 m-70 -75.93 71.51 2.74 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 124.032 0.933 . . . . 0.0 109.562 175.78 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -153.48 141.57 13.9 Favored Pre-proline 0 N--CA 1.453 -0.277 0 C-N-CA 126.464 1.906 . . . . 0.0 106.833 178.191 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_endo -79.77 60.04 7.66 Favored 'Trans proline' 0 N--CA 1.457 -0.655 0 C-N-CA 123.535 2.823 . . . . 0.0 110.359 179.204 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 2.2 t30 66.26 107.09 0.04 OUTLIER 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 127.198 2.199 . . . . 0.0 111.351 177.283 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 75.9 mt -57.12 -65.78 0.56 Allowed 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 123.889 0.876 . . . . 0.0 109.645 178.258 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 43.7 p-10 -159.09 21.39 0.2 Allowed 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 124.199 1.0 . . . . 0.0 111.298 171.912 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 73.8 -52.66 0.69 Allowed 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 126.408 1.883 . . . . 0.0 111.535 -176.986 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -55.4 -68.34 0.2 Allowed 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.944 1.298 . . . . 0.0 110.66 177.958 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 99.9 mm-40 -63.04 -38.56 91.68 Favored 'General case' 0 N--CA 1.457 -0.112 0 C-N-CA 124.2 1.0 . . . . 0.0 110.856 -177.6 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -49.38 -66.3 0.42 Allowed 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 125.044 1.338 . . . . 0.0 110.415 174.239 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 14.4 m-80 -65.43 -38.55 90.24 Favored 'General case' 0 CA--C 1.527 0.082 0 CA-C-O 119.188 -0.434 . . . . 0.0 111.173 -176.668 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -54.36 -47.11 72.97 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 122.931 0.493 . . . . 0.0 111.004 177.78 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 60.1 mttp -59.11 -59.62 5.17 Favored 'General case' 0 C--N 1.342 0.245 0 N-CA-C 109.922 -0.399 . . . . 0.0 109.922 176.602 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 28.4 mm -50.52 -47.07 27.58 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.433 0 C-N-CA 123.794 0.838 . . . . 0.0 111.428 -175.76 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -66.78 -53.4 33.35 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 123.658 0.783 . . . . 0.0 111.607 -179.111 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 89.2 p -60.44 -41.15 93.47 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 123.082 0.553 . . . . 0.0 112.073 -176.738 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 68.0 mt -57.44 -44.42 84.52 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.18 0 C-N-CA 124.759 1.224 . . . . 0.0 110.259 176.073 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 73.6 mtm180 -79.98 57.21 2.57 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 123.273 0.629 . . . . 0.0 110.942 177.255 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 24.9 p-10 . . . . . 0 CA--C 1.532 0.284 0 C-N-CA 125.009 1.324 . . . . 0.0 109.764 171.094 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.733 0 N-CA-C 111.19 0.07 . . . . 0.0 111.19 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 3.8 t 57.97 59.26 0.25 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 C-N-CA 125.498 1.519 . . . . 0.0 110.446 -178.842 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -91.22 148.28 22.46 Favored 'General case' 0 C--N 1.339 0.11 0 C-N-CA 123.034 0.534 . . . . 0.0 109.98 176.704 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 16.3 pt20 -78.03 8.71 4.39 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.386 0.674 . . . . 0.0 112.684 176.401 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 45.2 t -155.4 71.43 0.77 Allowed 'General case' 0 C--N 1.342 0.255 0 C-N-CA 124.914 1.285 . . . . 0.0 107.994 172.853 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 33.5 p90 -75.69 32.44 0.11 Allowed 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 125.506 1.523 . . . . 0.0 114.664 -169.874 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 36.4 m-80 -130.3 -51.74 1.1 Allowed 'General case' 0 C--N 1.332 -0.182 0 C-N-CA 125.439 1.496 . . . . 0.0 108.464 175.063 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 58.3 mtt -72.11 -48.47 43.63 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 123.192 0.597 . . . . 0.0 110.103 175.201 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 18.6 tp60 -75.16 -58.02 3.54 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 178.629 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 34.7 mt-30 -87.11 108.71 19.01 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 -178.412 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -151.08 -49.03 0.12 Allowed 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 125.221 1.408 . . . . 0.0 110.28 178.869 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 15.6 tpt180 -58.85 -36.91 75.35 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 123.124 0.57 . . . . 0.0 111.376 176.516 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -62.13 -49.28 76.51 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 123.065 0.546 . . . . 0.0 110.289 -179.685 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 85.8 m-85 -60.24 -46.09 90.99 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 123.263 0.625 . . . . 0.0 110.991 177.565 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 46.9 t80 -54.96 -48.3 73.37 Favored 'General case' 0 C--N 1.341 0.197 0 C-N-CA 122.934 0.494 . . . . 0.0 110.699 175.475 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -63.48 -46.66 85.17 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 122.709 0.404 . . . . 0.0 110.553 -176.598 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.04 -39.81 95.85 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 124.002 0.921 . . . . 0.0 111.824 178.903 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 66.9 tp -69.02 -48.6 62.56 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 123.515 0.726 . . . . 0.0 110.238 179.148 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 17.3 m-70 -81.84 61.77 5.34 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.292 1.037 . . . . 0.0 109.164 177.631 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 62.1 t0 -146.63 82.62 8.65 Favored Pre-proline 0 CA--C 1.533 0.319 0 C-N-CA 124.886 1.274 . . . . 0.0 108.022 179.33 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -69.09 -25.18 31.94 Favored 'Trans proline' 0 N--CA 1.455 -0.748 0 C-N-CA 123.093 2.529 . . . . 0.0 112.082 -177.346 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 17.8 m-80 -54.28 -48.97 70.65 Favored 'General case' 0 C--N 1.342 0.246 0 C-N-CA 124.248 1.019 . . . . 0.0 109.937 177.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -72.24 118.71 15.46 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 107.145 -1.428 . . . . 0.0 107.145 170.124 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 7.0 p-10 -66.68 160.37 25.72 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 123.504 0.722 . . . . 0.0 110.475 178.016 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -75.18 72.6 2.28 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.103 0.961 . . . . 0.0 111.115 -175.252 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.3 tp10 -171.62 -51.22 0.02 OUTLIER 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 127.139 2.175 . . . . 0.0 106.992 175.344 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 36.1 mm-40 -71.15 -45.48 63.45 Favored 'General case' 0 CA--C 1.53 0.184 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 170.51 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 27.6 ttm180 -52.46 -49.12 65.3 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 124.645 1.178 . . . . 0.0 109.926 170.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 50.7 t30 -61.42 -42.31 98.54 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.557 0.743 . . . . 0.0 110.783 178.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.67 -40.76 88.83 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 122.883 0.473 . . . . 0.0 111.425 177.218 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 62.6 mtpt -59.22 -47.33 85.75 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 118.375 0.534 . . . . 0.0 110.722 175.478 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 33.1 mm -56.78 -53.21 44.94 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.267 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 176.258 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 58.9 mttp -79.3 55.01 1.8 Allowed 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 125.308 1.443 . . . . 0.0 110.376 177.526 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 44.5 t -165.98 -48.63 0.03 OUTLIER 'General case' 0 N--CA 1.456 -0.155 0 C-N-CA 125.625 1.57 . . . . 0.0 108.178 -179.56 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 72.2 mt -54.79 -43.57 67.7 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 171.273 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 13.3 ptp180 -73.33 -49.38 27.74 Favored 'General case' 0 C--N 1.342 0.277 0 CA-C-N 117.982 0.355 . . . . 0.0 111.411 171.243 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -86.63 76.81 9.48 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 124.016 0.926 . . . . 0.0 110.002 -173.616 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 40.9 p-10 . . . . . 0 C--O 1.25 1.092 0 CA-C-O 116.764 -1.589 . . . . 0.0 110.941 179.486 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 0.706 0 N-CA-C 111.641 0.237 . . . . 0.0 111.641 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 13.4 p -75.49 137.88 22.0 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.188 0 C-N-CA 123.365 0.666 . . . . 0.0 109.449 177.048 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -62.14 123.64 18.7 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 123.453 0.701 . . . . 0.0 110.302 -179.598 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 30.5 tp60 -74.65 98.68 3.47 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 108.219 -1.03 . . . . 0.0 108.219 177.89 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 33.3 t -152.1 75.4 1.13 Allowed 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 123.936 0.894 . . . . 0.0 109.846 -174.111 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 15.7 m-30 -83.99 55.53 3.33 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 172.032 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 27.6 m-20 -0.8 -90.96 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 129.57 3.148 . . . . 0.0 114.933 -170.815 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 4.2 mpp? -60.59 -50.1 74.89 Favored 'General case' 0 CA--C 1.529 0.15 0 C-N-CA 123.717 0.807 . . . . 0.0 111.087 -172.695 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 31.0 mm-40 -56.13 -49.19 74.61 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 123.423 0.689 . . . . 0.0 110.429 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 37.0 tt0 -64.97 -39.39 93.41 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 124.654 1.182 . . . . 0.0 111.605 -177.242 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 -57.61 -42.29 82.97 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 123.403 0.681 . . . . 0.0 110.173 172.76 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 6.4 mmp_? -65.91 -32.19 73.55 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-O 118.834 -0.603 . . . . 0.0 112.16 175.267 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 16.7 mmm180 -65.1 -47.59 76.65 Favored 'General case' 0 C--N 1.341 0.232 0 CA-C-N 119.09 0.859 . . . . 0.0 110.836 175.606 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 47.7 m-85 -59.4 -56.11 26.21 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 122.668 0.387 . . . . 0.0 110.751 175.575 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 70.8 t80 -48.03 -52.28 20.66 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 125.626 1.57 . . . . 0.0 110.8 179.138 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 4.4 tm-20 -53.57 -57.9 9.1 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.826 1.25 . . . . 0.0 110.409 175.91 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -53.49 -44.04 68.7 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 124.006 0.922 . . . . 0.0 112.435 -177.866 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 7.1 mp -61.35 -54.32 45.28 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 124.102 0.961 . . . . 0.0 111.283 179.519 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 32.5 m-70 -76.55 -48.14 20.32 Favored 'General case' 0 N--CA 1.457 -0.124 0 N-CA-C 113.046 0.758 . . . . 0.0 113.046 -169.908 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -54.78 113.92 6.1 Favored Pre-proline 0 CA--C 1.535 0.392 0 C-N-CA 124.238 1.015 . . . . 0.0 111.709 -174.288 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -54.95 -40.87 83.59 Favored 'Trans proline' 0 C--N 1.348 0.525 0 C-N-CA 123.481 2.787 . . . . 0.0 112.177 174.34 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 5.0 p30 -57.08 -36.36 70.48 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 123.95 0.9 . . . . 0.0 111.443 177.688 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -80.09 70.74 6.75 Favored 'General case' 0 C--N 1.343 0.31 0 N-CA-C 106.723 -1.584 . . . . 0.0 106.723 169.305 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 8.5 p30 -65.95 168.53 8.0 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 125.208 1.403 . . . . 0.0 110.368 177.415 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -34.59 -64.01 0.27 Allowed 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 126.108 1.763 . . . . 0.0 114.38 -169.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -60.6 -38.64 85.33 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 -176.736 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 25.4 mm100 -70.24 -41.26 73.79 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 123.43 0.692 . . . . 0.0 110.807 179.421 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 64.4 ttp85 -60.47 -45.52 93.43 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 124.388 1.075 . . . . 0.0 110.09 175.538 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 4.6 m-80 -62.06 -40.2 94.98 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 122.885 0.474 . . . . 0.0 110.796 175.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -62.04 -44.16 97.29 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 118.228 0.467 . . . . 0.0 111.349 176.292 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 10.5 mmmm -57.15 -55.87 29.1 Favored 'General case' 0 C--N 1.342 0.273 0 C-N-CA 123.074 0.549 . . . . 0.0 109.909 174.401 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 75.2 mt -52.66 -48.84 47.75 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.298 0 C-N-CA 123.714 0.806 . . . . 0.0 110.837 -179.887 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 66.5 tttm -60.99 -49.86 75.72 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 123.925 0.89 . . . . 0.0 111.296 -178.728 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 78.6 p -64.77 -41.04 96.18 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 123.2 0.6 . . . . 0.0 111.741 -178.328 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 72.4 mt -59.47 -45.1 94.01 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 C-N-CA 123.543 0.737 . . . . 0.0 109.326 173.48 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 54.0 ttp180 -78.23 58.82 2.14 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 125.139 1.376 . . . . 0.0 109.839 176.813 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -73.58 -50.05 23.2 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 124.237 1.015 . . . . 0.0 110.439 179.645 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 13.2 t70 . . . . . 0 C--O 1.249 1.059 0 CA-C-O 117.362 -1.304 . . . . 0.0 108.485 -177.525 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 0.682 0 N-CA-C 111.661 0.245 . . . . 0.0 111.661 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 73.8 t -67.95 128.47 31.35 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.228 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 -179.664 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -74.66 77.11 2.03 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 124.502 1.121 . . . . 0.0 111.413 -174.144 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 30.5 mt-30 -131.72 -79.3 0.51 Allowed 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 125.499 1.519 . . . . 0.0 108.094 176.287 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 58.3 m -152.49 65.64 0.82 Allowed 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 125.171 1.388 . . . . 0.0 107.466 177.146 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 44.1 p90 -94.8 -14.38 24.72 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 124.488 1.115 . . . . 0.0 113.121 -173.866 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 37.4 t30 -102.71 -87.34 0.42 Allowed 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 123.621 0.768 . . . . 0.0 110.354 -173.424 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 14.1 tpt -85.17 64.41 8.66 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 123.72 0.808 . . . . 0.0 109.522 -174.233 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 9.0 tp-100 -173.17 -61.15 0.02 OUTLIER 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 126.023 1.729 . . . . 0.0 106.631 -177.878 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -85.86 84.48 7.54 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 108.032 -1.099 . . . . 0.0 108.032 173.353 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 15.3 tp60 -154.45 -58.86 0.11 Allowed 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 108.075 -1.083 . . . . 0.0 108.075 179.457 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 3.4 tpm_? -60.66 -45.31 94.6 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 170.105 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 94.8 mtt-85 -54.8 -52.24 63.26 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 124.745 1.218 . . . . 0.0 110.639 177.129 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 21.1 m-85 -59.2 -44.03 92.24 Favored 'General case' 0 C--N 1.34 0.183 0 CA-C-O 119.085 -0.483 . . . . 0.0 111.426 177.789 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 49.3 t80 -59.66 -51.62 69.0 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 118.468 0.576 . . . . 0.0 110.578 178.797 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -55.89 -42.83 76.54 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 123.563 0.745 . . . . 0.0 110.998 179.409 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.77 -57.52 9.69 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.268 0.627 . . . . 0.0 111.576 178.512 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 72.6 mt -60.08 -53.64 55.35 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 124.467 1.107 . . . . 0.0 111.401 -176.481 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 36.6 m-70 -82.64 64.35 7.23 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.156 0.982 . . . . 0.0 109.217 -177.148 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 36.9 t0 -134.32 87.18 33.77 Favored Pre-proline 0 CA--C 1.533 0.301 0 C-N-CA 125.31 1.444 . . . . 0.0 107.949 179.77 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 96.1 Cg_exo -48.01 -43.59 29.89 Favored 'Trans proline' 0 N--CA 1.459 -0.555 0 C-N-CA 124.757 3.638 . . . . 0.0 113.885 -179.12 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 20.3 m120 -60.47 -48.84 80.0 Favored 'General case' 0 CA--C 1.529 0.141 0 C-N-CA 124.04 0.936 . . . . 0.0 111.442 -176.897 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 10.4 mp -75.57 133.28 40.99 Favored 'General case' 0 N--CA 1.456 -0.172 0 C-N-CA 122.938 0.495 . . . . 0.0 109.961 -179.162 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 20.5 p30 -79.41 177.26 8.99 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.517 0.727 . . . . 0.0 111.047 178.414 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -51.55 -48.4 63.09 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 124.432 1.093 . . . . 0.0 112.271 -178.026 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 13.8 tp10 -64.86 -42.87 94.5 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 122.933 0.493 . . . . 0.0 111.173 -178.078 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 65.9 mt-30 -62.36 -41.76 98.86 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 122.863 0.465 . . . . 0.0 110.837 177.735 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 95.5 mtt180 -60.3 -50.73 72.49 Favored 'General case' 0 C--O 1.225 -0.192 0 C-N-CA 122.887 0.475 . . . . 0.0 109.897 174.529 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 78.9 m-20 -53.25 -45.13 68.67 Favored 'General case' 0 C--N 1.341 0.208 0 C-N-CA 123.598 0.759 . . . . 0.0 111.088 178.216 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.75 -43.31 90.25 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 123.559 0.743 . . . . 0.0 111.108 176.734 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 79.2 mttt -59.36 -49.77 76.53 Favored 'General case' 0 C--N 1.341 0.235 0 CA-C-O 118.231 -0.89 . . . . 0.0 111.077 173.359 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 8.3 mm -56.73 -47.58 82.34 Favored 'Isoleucine or valine' 0 C--N 1.343 0.303 0 CA-C-N 119.418 1.008 . . . . 0.0 109.738 -178.337 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 27.3 ttpp -56.63 -45.74 81.37 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.255 1.022 . . . . 0.0 111.63 177.876 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 23.1 t -62.3 -47.44 84.28 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 123.298 0.639 . . . . 0.0 111.009 178.703 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 60.3 mt -60.82 -38.31 78.67 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 C-N-CA 125.005 1.322 . . . . 0.0 110.158 178.72 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 2.4 mmp_? -65.45 -1.04 2.21 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 124.999 1.319 . . . . 0.0 114.345 178.241 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -54.73 -49.35 71.0 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 123.458 0.703 . . . . 0.0 111.518 173.178 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 . . . . . 0 C--O 1.25 1.087 0 CA-C-O 117.539 -1.219 . . . . 0.0 111.013 -179.593 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.78 0 N-CA-C 111.686 0.254 . . . . 0.0 111.686 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 27.4 t -80.01 78.99 1.0 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.239 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 179.372 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -59.03 -40.54 85.35 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 124.211 1.005 . . . . 0.0 111.055 176.22 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 10.6 pt20 -154.42 179.34 9.1 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 124.387 1.075 . . . . 0.0 109.491 176.518 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 7.4 p -78.57 110.36 13.6 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 105.34 -2.096 . . . . 0.0 105.34 169.546 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 51.3 m-85 -79.14 76.59 5.66 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 123.806 0.843 . . . . 0.0 109.876 -171.277 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 42.6 p-10 -43.37 -43.09 4.93 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 126.062 1.745 . . . . 0.0 114.327 179.691 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 28.1 ttt -61.66 -53.57 54.4 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.722 0.809 . . . . 0.0 111.023 179.493 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 26.4 tt0 -62.08 -48.48 80.02 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.315 1.046 . . . . 0.0 110.396 179.219 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 35.8 mt-30 -86.71 20.29 2.6 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 125.95 1.7 . . . . 0.0 111.55 -175.696 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 20.8 tm0? -53.72 -36.97 62.84 Favored 'General case' 0 C--N 1.343 0.314 0 C-N-CA 124.46 1.104 . . . . 0.0 110.131 174.795 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 3.3 mpt_? -63.35 -54.91 29.45 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 123.897 0.879 . . . . 0.0 109.739 179.334 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 19.7 mmm180 -58.58 -47.92 82.67 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 124.04 0.936 . . . . 0.0 110.284 -178.257 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 26.8 t80 -54.55 -48.76 71.65 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 127.367 2.267 . . . . 0.0 111.646 175.874 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 79.7 t80 -65.0 -45.2 86.57 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 124.886 1.274 . . . . 0.0 110.967 -179.573 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -56.46 -51.95 66.51 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.339 0.656 . . . . 0.0 110.081 174.661 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.05 -41.44 87.9 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 124.102 0.961 . . . . 0.0 111.68 179.413 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 49.9 tp -58.56 -46.1 87.58 Favored 'General case' 0 C--N 1.339 0.14 0 C-N-CA 123.759 0.823 . . . . 0.0 110.137 177.643 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 23.0 m-70 -96.67 55.08 1.37 Allowed 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 123.981 0.912 . . . . 0.0 110.148 -178.415 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -142.28 89.17 8.67 Favored Pre-proline 0 CA--C 1.533 0.302 0 C-N-CA 123.816 0.846 . . . . 0.0 109.656 179.346 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_exo -53.48 -30.2 52.8 Favored 'Trans proline' 0 N--CA 1.458 -0.56 0 C-N-CA 124.397 3.398 . . . . 0.0 113.84 175.846 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 11.9 m120 -52.81 -47.71 67.45 Favored 'General case' 0 C--N 1.343 0.316 0 C-N-CA 124.294 1.038 . . . . 0.0 110.707 179.52 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 46.4 mt -69.14 118.45 12.05 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 107.061 -1.459 . . . . 0.0 107.061 169.555 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 12.7 p30 -61.75 156.57 19.99 Favored 'General case' 0 CA--C 1.529 0.155 0 C-N-CA 123.193 0.597 . . . . 0.0 110.96 -178.382 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 9.6 mp0 -47.78 -50.97 24.1 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 125.181 1.393 . . . . 0.0 111.995 -175.778 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -58.37 -59.99 4.49 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 123.104 0.561 . . . . 0.0 111.028 -175.22 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 29.5 mm100 -62.65 -45.56 92.25 Favored 'General case' 0 CA--C 1.529 0.155 0 C-N-CA 123.23 0.612 . . . . 0.0 111.123 -177.405 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 41.2 ttp180 -56.39 -58.93 5.92 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 123.996 0.918 . . . . 0.0 110.372 179.9 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 62.3 m-20 -62.47 -35.27 78.79 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 123.563 0.745 . . . . 0.0 111.343 -176.752 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -62.52 -48.92 77.42 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 122.811 0.444 . . . . 0.0 110.868 175.232 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 59.6 mtpt -59.97 -46.82 88.18 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 123.603 0.761 . . . . 0.0 110.823 178.579 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 24.9 mm -54.41 -57.45 6.18 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.261 0 C-N-CA 123.708 0.803 . . . . 0.0 109.658 174.891 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 82.0 tttt -80.47 59.2 3.42 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.598 1.159 . . . . 0.0 109.787 178.66 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 46.5 t -168.86 -46.32 0.02 OUTLIER 'General case' 0 N--CA 1.456 -0.174 0 C-N-CA 126.507 1.923 . . . . 0.0 107.929 179.824 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 53.2 mt -53.12 -54.21 18.49 Favored 'Isoleucine or valine' 0 C--N 1.342 0.277 0 C-N-CA 123.717 0.807 . . . . 0.0 109.075 169.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 9.8 ptp180 -82.28 64.4 6.92 Favored 'General case' 0 C--N 1.342 0.248 0 CA-C-O 121.069 0.461 . . . . 0.0 111.216 175.749 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -69.11 -40.09 78.55 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 123.474 0.71 . . . . 0.0 109.613 169.816 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 30.3 t70 . . . . . 0 C--O 1.25 1.084 0 C-N-CA 125.348 1.459 . . . . 0.0 107.487 177.732 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.725 0 N-CA-C 111.662 0.245 . . . . 0.0 111.662 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 16.5 m -81.91 59.05 0.17 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.363 0 C-N-CA 124.169 0.987 . . . . 0.0 110.532 -179.549 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -78.34 75.64 4.86 Favored 'General case' 0 N--CA 1.456 -0.171 0 C-N-CA 124.074 0.949 . . . . 0.0 109.247 178.528 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 20.7 tp60 70.15 -62.15 0.44 Allowed 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 127.044 2.138 . . . . 0.0 111.688 -176.302 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 94.3 p -159.2 173.01 17.03 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 123.558 0.743 . . . . 0.0 110.77 178.336 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 40.3 p90 -59.23 -36.44 75.44 Favored 'General case' 0 C--N 1.34 0.19 0 C-N-CA 123.837 0.855 . . . . 0.0 112.807 -173.436 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 11.6 t30 -44.97 -43.44 9.06 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 124.906 1.282 . . . . 0.0 112.445 177.465 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 1.8 mpt? -64.59 -46.26 83.48 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 123.528 0.731 . . . . 0.0 110.428 -176.648 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 28.1 mm-40 -63.34 -40.19 96.62 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 122.951 0.501 . . . . 0.0 110.325 175.481 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 80.5 mt-30 -78.4 3.7 15.06 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 124.363 1.065 . . . . 0.0 113.553 -177.099 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 -51.68 -39.06 57.56 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 120.286 1.403 . . . . 0.0 111.451 175.535 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 25.6 mmm180 -56.32 -65.96 0.52 Allowed 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 124.079 0.952 . . . . 0.0 110.778 175.794 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 58.2 mtp180 -50.5 -43.56 55.67 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 125.234 1.413 . . . . 0.0 111.561 178.812 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 80.9 t80 -61.04 -53.8 52.69 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 126.919 2.087 . . . . 0.0 111.695 -177.239 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -72.02 -32.59 67.29 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 118.468 0.576 . . . . 0.0 111.171 -179.75 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 25.5 mm-40 -61.46 -42.39 98.7 Favored 'General case' 0 CA--C 1.532 0.269 0 O-C-N 121.628 -0.67 . . . . 0.0 110.182 172.763 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.35 -47.93 83.64 Favored 'General case' 0 N--CA 1.456 -0.172 0 C-N-CA 123.198 0.599 . . . . 0.0 110.483 176.191 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 34.1 tp -50.6 -44.47 57.04 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.682 1.193 . . . . 0.0 110.991 175.419 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 28.1 m170 -78.54 -40.21 35.62 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 123.751 0.82 . . . . 0.0 113.188 -174.113 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.31 140.89 94.48 Favored Pre-proline 0 CA--C 1.537 0.446 0 CA-C-N 119.056 0.844 . . . . 0.0 111.36 -170.011 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_endo -78.86 -37.83 0.55 Allowed 'Trans proline' 0 N--CA 1.455 -0.78 0 C-N-CA 123.289 2.659 . . . . 0.0 112.43 -178.032 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 3.4 p-10 -58.14 -40.85 82.37 Favored 'General case' 0 C--N 1.341 0.23 0 N-CA-C 113.798 1.036 . . . . 0.0 113.798 -169.808 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 68.2 mt -70.3 117.91 12.45 Favored 'General case' 0 N--CA 1.455 -0.186 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 173.019 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 32.9 p-10 -73.1 176.65 5.63 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 123.376 0.67 . . . . 0.0 110.73 178.779 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.9 mp0 -81.54 55.82 2.77 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 123.645 0.778 . . . . 0.0 109.953 179.507 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 56.5 mt-10 -147.17 -60.92 0.28 Allowed 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 126.881 2.072 . . . . 0.0 105.958 169.974 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 37.2 mm-40 -67.81 -44.08 78.14 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 123.892 0.877 . . . . 0.0 110.439 178.709 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 20.1 ttm180 -58.63 -55.96 28.38 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 123.072 0.549 . . . . 0.0 109.634 177.846 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 22.9 m120 -62.07 -37.91 86.82 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-O 119.158 -0.449 . . . . 0.0 111.374 -177.325 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.3 -48.72 80.58 Favored 'General case' 0 C--N 1.341 0.21 0 CA-C-N 118.239 0.472 . . . . 0.0 110.935 175.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 25.0 mmtp -56.73 -56.86 16.13 Favored 'General case' 0 C--N 1.341 0.203 0 C-N-CA 123.127 0.571 . . . . 0.0 110.338 176.421 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 23.1 mm -50.98 -57.74 2.53 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.235 0 C-N-CA 123.948 0.899 . . . . 0.0 110.408 -179.151 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -53.28 -50.38 64.98 Favored 'General case' 0 N--CA 1.456 -0.164 0 C-N-CA 125.065 1.346 . . . . 0.0 111.044 -179.134 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 35.4 t -58.33 -46.26 86.56 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.694 0.798 . . . . 0.0 111.492 -179.09 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 59.6 mt -65.8 -50.13 72.7 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 C-N-CA 123.008 0.523 . . . . 0.0 110.558 -175.875 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 18.5 ptp180 -66.51 -33.72 76.32 Favored 'General case' 0 C--N 1.342 0.272 0 CA-C-N 118.223 0.465 . . . . 0.0 112.044 179.149 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -76.77 69.17 3.1 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 108.5 -0.926 . . . . 0.0 108.5 171.881 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 11.0 t70 . . . . . 0 C--O 1.25 1.081 0 CA-C-O 117.176 -1.392 . . . . 0.0 110.634 -171.607 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.744 0 N-CA-C 111.783 0.29 . . . . 0.0 111.783 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 14.6 t 58.52 70.25 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.342 0 C-N-CA 125.13 1.372 . . . . 0.0 109.756 -178.584 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -79.52 64.72 4.48 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.109 0.964 . . . . 0.0 109.825 178.551 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 7.2 pt20 -65.3 -33.72 76.65 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 124.69 1.196 . . . . 0.0 112.168 -177.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 48.5 t -55.52 122.98 12.49 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 123.972 0.909 . . . . 0.0 110.043 -179.369 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -77.57 55.93 1.37 Allowed 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 124.409 1.083 . . . . 0.0 108.285 173.191 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -44.7 -49.59 10.4 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 125.939 1.696 . . . . 0.0 114.289 -169.799 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 28.1 ptm -53.68 -34.4 58.57 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 112.575 0.583 . . . . 0.0 112.575 -178.607 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 23.1 mt-30 -81.72 -60.07 2.38 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 124.168 0.987 . . . . 0.0 109.148 170.468 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 17.6 tt0 -71.36 65.31 0.42 Allowed 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 128.315 2.646 . . . . 0.0 110.725 -177.705 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 19.1 tp60 -163.54 -56.91 0.04 OUTLIER 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 124.435 1.094 . . . . 0.0 110.059 179.288 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 30.9 tpt180 -72.39 -77.98 0.09 Allowed 'General case' 0 C--N 1.341 0.227 0 C-N-CA 122.854 0.461 . . . . 0.0 110.895 -172.701 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.77 -26.83 66.03 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 122.672 0.389 . . . . 0.0 111.562 178.733 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 76.3 t80 -61.22 -56.66 18.12 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 126.425 1.89 . . . . 0.0 110.514 175.486 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 55.7 t80 -58.47 -49.64 76.63 Favored 'General case' 0 C--N 1.341 0.207 0 C-N-CA 122.649 0.38 . . . . 0.0 110.215 176.79 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -56.89 -44.73 82.61 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 122.838 0.455 . . . . 0.0 111.451 -177.827 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.95 -53.87 52.76 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 123.589 0.755 . . . . 0.0 111.49 179.719 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 55.1 tp -63.45 -52.67 60.43 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 122.766 0.426 . . . . 0.0 110.554 -178.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 24.8 m-70 -81.43 64.39 6.13 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 124.465 1.106 . . . . 0.0 109.696 -179.084 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -150.82 115.25 3.22 Favored Pre-proline 0 CA--C 1.533 0.302 0 C-N-CA 124.89 1.276 . . . . 0.0 108.181 175.853 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 94.4 Cg_endo -77.82 -25.11 8.01 Favored 'Trans proline' 0 N--CA 1.455 -0.754 0 C-N-CA 123.249 2.633 . . . . 0.0 112.052 -177.85 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 -56.13 -55.18 36.18 Favored 'General case' 0 C--N 1.342 0.265 0 C-N-CA 123.775 0.83 . . . . 0.0 110.619 -178.796 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 91.0 mt -79.41 141.37 36.9 Favored 'General case' 0 N--CA 1.453 -0.28 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 172.64 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 43.8 p-10 -96.68 176.51 5.98 Favored 'General case' 0 C--O 1.233 0.189 0 C-N-CA 124.493 1.117 . . . . 0.0 110.396 179.485 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -79.37 62.4 3.7 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 124.123 0.969 . . . . 0.0 110.453 175.514 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 64.8 mt-10 -148.2 -47.27 0.16 Allowed 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 127.18 2.192 . . . . 0.0 106.794 169.773 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 22.9 mm100 -80.34 -56.65 4.05 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 124.063 0.945 . . . . 0.0 109.71 173.365 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 21.7 ptt180 -68.0 -41.83 81.66 Favored 'General case' 0 C--N 1.341 0.23 0 CA-C-O 119.526 -0.273 . . . . 0.0 111.151 -173.722 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 43.2 p-10 -62.93 -35.81 81.32 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 117.951 0.341 . . . . 0.0 111.622 -178.112 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -60.73 -44.81 96.18 Favored 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 123.687 0.795 . . . . 0.0 110.567 175.199 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 57.0 mtmt -61.44 -48.91 79.0 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-O 119.423 -0.322 . . . . 0.0 110.712 175.729 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 27.9 mm -55.93 -45.02 79.86 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 C-N-CA 124.056 0.942 . . . . 0.0 111.326 179.294 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 88.6 mttt -61.5 -47.43 85.68 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 123.704 0.801 . . . . 0.0 110.689 175.425 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 23.1 t -61.92 -43.57 98.57 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 123.915 0.886 . . . . 0.0 112.012 -177.589 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 58.4 mt -61.59 -35.58 68.0 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.222 0 C-N-CA 124.102 0.961 . . . . 0.0 109.905 177.401 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 85.3 mtm180 -78.31 52.59 1.15 Allowed 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.27 0.628 . . . . 0.0 111.479 173.248 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -83.71 -31.46 26.04 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 124.491 1.116 . . . . 0.0 109.445 169.579 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 28.4 t70 . . . . . 0 C--O 1.252 1.202 0 C-N-CA 125.337 1.455 . . . . 0.0 108.124 -179.164 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.744 0 N-CA-C 111.671 0.248 . . . . 0.0 111.671 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 15.6 m -82.33 49.12 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.457 0 C-N-CA 124.401 1.081 . . . . 0.0 111.021 -179.409 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -78.51 107.31 11.07 Favored 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 124.32 1.048 . . . . 0.0 109.371 -179.153 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 16.9 tt0 55.89 50.25 14.35 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 124.58 1.152 . . . . 0.0 110.174 -175.795 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 40.6 t -94.77 170.56 9.36 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 124.919 1.288 . . . . 0.0 109.314 177.826 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 69.3 m-85 -75.1 70.42 2.07 Favored 'General case' 0 C--N 1.34 0.181 0 C-N-CA 124.649 1.179 . . . . 0.0 110.988 -177.305 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 4.3 p-10 -179.19 -40.71 0.01 OUTLIER 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 128.432 2.693 . . . . 0.0 107.695 -175.007 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 20.6 mmt -76.68 -51.03 12.26 Favored 'General case' 0 C--N 1.341 0.234 0 N-CA-C 107.386 -1.339 . . . . 0.0 107.386 169.41 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 49.6 mt-30 -54.56 -47.44 73.24 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 124.602 1.161 . . . . 0.0 109.769 172.341 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 26.8 mt-30 -89.8 18.24 5.82 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.304 1.041 . . . . 0.0 112.061 -176.077 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 11.9 tp-100 -66.38 -46.08 77.87 Favored 'General case' 0 C--N 1.341 0.23 0 CA-C-N 118.944 0.793 . . . . 0.0 110.042 179.638 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 9.1 mmm180 -58.4 -36.59 73.79 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.785 0.834 . . . . 0.0 111.426 173.042 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 12.0 mmp_? -68.52 -37.22 79.84 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 123.581 0.753 . . . . 0.0 110.534 179.634 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 15.6 m-30 -65.29 -48.86 71.67 Favored 'General case' 0 N--CA 1.455 -0.196 0 CA-C-O 119.428 -0.32 . . . . 0.0 110.157 172.198 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 21.3 m-85 -79.39 60.27 3.12 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 123.904 0.882 . . . . 0.0 109.987 175.716 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.7 tm-20 -175.57 -50.33 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 127.182 2.193 . . . . 0.0 106.99 -174.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -73.8 -53.03 11.18 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 124.179 0.992 . . . . 0.0 110.896 175.856 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 58.5 tp -73.4 -54.89 7.22 Favored 'General case' 0 C--N 1.34 0.166 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 175.157 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 56.0 m-70 -84.01 59.78 5.48 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 123.423 0.689 . . . . 0.0 109.696 178.898 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -94.57 137.62 22.53 Favored Pre-proline 0 CA--C 1.533 0.322 0 C-N-CA 124.439 1.096 . . . . 0.0 108.239 174.531 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_exo -42.43 -52.94 4.01 Favored 'Trans proline' 0 N--CA 1.458 -0.59 0 C-N-CA 124.004 3.136 . . . . 0.0 114.136 173.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 5.9 p-10 -160.31 131.94 5.95 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 123.621 0.768 . . . . 0.0 110.54 -179.573 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 92.8 mt -140.5 -126.95 0.11 Allowed 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 125.4 1.48 . . . . 0.0 107.104 172.704 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 51.6 p-10 -155.07 23.58 0.43 Allowed 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.768 0.827 . . . . 0.0 111.957 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 74.17 -54.28 0.68 Allowed 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 125.91 1.684 . . . . 0.0 112.109 -177.47 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -52.58 -59.64 4.22 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 124.465 1.106 . . . . 0.0 110.24 178.067 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 83.8 mt-30 -58.82 -43.31 90.57 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 124.803 1.241 . . . . 0.0 110.897 178.652 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 59.2 ttm-85 -55.51 -54.98 37.13 Favored 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 124.807 1.243 . . . . 0.0 111.218 -177.502 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 28.8 m-80 -71.23 -38.16 71.99 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 123.061 0.544 . . . . 0.0 111.146 179.804 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.19 -43.74 87.69 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 118.434 0.561 . . . . 0.0 111.233 177.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 58.6 mtpt -59.59 -50.99 71.76 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 123.129 0.571 . . . . 0.0 109.929 175.709 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 11.6 mm -52.99 -51.75 35.23 Favored 'Isoleucine or valine' 0 C--N 1.341 0.226 0 C-N-CA 123.019 0.527 . . . . 0.0 111.045 178.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 67.6 mttm -57.68 -49.63 75.85 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 123.527 0.731 . . . . 0.0 110.878 179.683 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 32.5 t -57.77 -51.29 70.16 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 124.072 0.949 . . . . 0.0 111.472 -179.119 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 67.1 mt -58.97 -58.26 7.66 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.223 0 C-N-CA 124.765 1.226 . . . . 0.0 109.435 179.722 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 61.1 ttm-85 -55.44 -42.28 73.99 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 125.136 1.374 . . . . 0.0 111.39 -175.721 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -77.39 68.56 3.52 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 123.957 0.903 . . . . 0.0 109.249 172.762 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 18.4 t70 . . . . . 0 C--O 1.25 1.124 0 CA-C-O 117.172 -1.394 . . . . 0.0 110.041 -178.696 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.741 0 N-CA-C 111.757 0.28 . . . . 0.0 111.757 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 42.6 t -78.59 84.11 1.03 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 179.335 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -154.55 151.33 28.75 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 124.776 1.231 . . . . 0.0 108.9 178.881 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 42.5 tt0 54.83 46.28 24.83 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 124.568 1.147 . . . . 0.0 110.76 -178.673 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 15.1 t -74.9 -8.47 56.57 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 123.561 0.744 . . . . 0.0 112.888 -176.327 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 47.8 p90 -69.11 -29.53 67.63 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 123.21 0.604 . . . . 0.0 111.096 176.26 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 32.9 m120 -76.72 59.54 1.57 Allowed 'General case' 0 C--N 1.343 0.29 0 C-N-CA 123.882 0.873 . . . . 0.0 110.563 170.344 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 95.1 mtp -143.91 -60.64 0.4 Allowed 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 127.478 2.311 . . . . 0.0 105.868 171.053 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 49.5 mm-40 -60.54 -43.75 96.85 Favored 'General case' 0 C--N 1.341 0.22 0 C-N-CA 124.275 1.03 . . . . 0.0 110.468 170.746 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 17.4 mm100 -56.51 -48.48 77.12 Favored 'General case' 0 C--O 1.225 -0.228 0 CA-C-O 119.092 -0.48 . . . . 0.0 110.747 176.026 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 16.1 mm100 -67.3 -38.64 85.32 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 123.753 0.821 . . . . 0.0 111.447 -177.188 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 4.0 tmt_? -62.84 -54.95 30.93 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 124.432 1.093 . . . . 0.0 110.265 176.531 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 89.4 mtt-85 -67.56 -32.73 73.7 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 124.067 0.947 . . . . 0.0 111.185 -177.144 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 3.5 t80 -56.98 -53.79 54.06 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 125.275 1.43 . . . . 0.0 110.294 169.953 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 70.9 t80 -57.42 -48.06 80.13 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 123.377 0.671 . . . . 0.0 110.724 179.747 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 73.2 mt-10 -56.13 -50.02 72.28 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 123.119 0.568 . . . . 0.0 111.077 175.791 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -56.81 -45.09 82.49 Favored 'General case' 0 C--N 1.341 0.207 0 C-N-CA 124.138 0.975 . . . . 0.0 111.462 179.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 1.1 tt -50.8 -41.26 57.05 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 124.454 1.102 . . . . 0.0 109.95 175.01 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 11.9 m-70 -100.52 25.64 7.53 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 124.437 1.095 . . . . 0.0 112.678 -176.169 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 80.0 m-20 -69.05 151.98 96.97 Favored Pre-proline 0 CA--C 1.538 0.486 0 CA-C-N 119.13 0.877 . . . . 0.0 109.946 174.884 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_exo -50.75 -63.64 0.27 Allowed 'Trans proline' 0 C--N 1.351 0.663 0 C-N-CA 123.962 3.108 . . . . 0.0 114.46 -173.831 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 -162.96 84.61 0.52 Allowed 'General case' 0 N--CA 1.456 -0.141 0 C-N-CA 123.189 0.596 . . . . 0.0 109.572 -176.077 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 89.6 mt -122.94 129.24 51.33 Favored 'General case' 0 N--CA 1.456 -0.135 0 N-CA-C 106.267 -1.753 . . . . 0.0 106.267 172.747 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 1.7 p30 -69.24 163.93 23.88 Favored 'General case' 0 CA--C 1.529 0.157 0 N-CA-C 112.883 0.697 . . . . 0.0 112.883 -169.533 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 -58.02 -28.52 64.52 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 124.372 1.069 . . . . 0.0 113.074 -172.002 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -57.64 -50.29 73.66 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 119.069 0.849 . . . . 0.0 109.902 173.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 47.5 mt-30 -65.39 -40.13 93.07 Favored 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 124.278 1.031 . . . . 0.0 110.378 -179.885 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 5.8 mmp_? -62.25 -65.0 0.75 Allowed 'General case' 0 C--N 1.342 0.257 0 N-CA-C 109.244 -0.651 . . . . 0.0 109.244 177.896 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 61.2 t30 -50.14 -38.7 40.47 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 124.909 1.284 . . . . 0.0 112.368 -176.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -54.6 -49.25 70.91 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 118.297 0.499 . . . . 0.0 111.103 174.013 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 95.5 mttt -62.54 -55.87 23.35 Favored 'General case' 0 C--N 1.342 0.241 0 CA-C-O 118.938 -0.553 . . . . 0.0 110.807 173.831 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 4.9 mm -57.73 -37.96 62.4 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 CA-C-N 118.294 0.497 . . . . 0.0 110.499 -171.056 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 17.6 tppt? -60.2 -50.98 71.51 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 124.265 1.026 . . . . 0.0 110.453 176.701 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 18.1 m -59.55 -44.96 93.09 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.59 0.756 . . . . 0.0 111.037 179.067 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 48.8 mt -62.69 -47.72 91.57 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 C-N-CA 125.386 1.474 . . . . 0.0 110.226 -179.347 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 78.4 mtm180 -56.91 -46.53 81.92 Favored 'General case' 0 C--N 1.34 0.193 0 C-N-CA 123.77 0.828 . . . . 0.0 110.282 174.325 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 53.0 m-20 -85.67 43.59 1.04 Allowed 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.773 0.829 . . . . 0.0 110.992 -178.846 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 39.1 t70 . . . . . 0 C--O 1.25 1.084 0 CA-C-O 117.013 -1.47 . . . . 0.0 109.145 177.11 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.728 0 CA-C-O 120.01 -0.043 . . . . 0.0 111.046 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 18.9 m -72.34 156.92 6.75 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.228 0 C-N-CA 122.879 0.472 . . . . 0.0 110.979 -178.065 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -71.28 153.04 42.71 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 123.508 0.723 . . . . 0.0 110.977 -179.601 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 55.1 mm-40 53.65 51.33 15.28 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 125.44 1.496 . . . . 0.0 111.296 -179.658 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 30.7 t -151.93 -98.71 0.06 Allowed 'General case' 0 N--CA 1.455 -0.21 0 N-CA-C 108.177 -1.046 . . . . 0.0 108.177 -179.048 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 95.5 m-85 -46.14 -39.79 10.09 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 126.268 1.827 . . . . 0.0 111.251 173.867 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 7.4 m120 -31.46 -48.52 0.14 Allowed 'General case' 0 CA--C 1.529 0.165 0 C-N-CA 128.151 2.58 . . . . 0.0 113.0 170.294 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -59.88 -52.5 65.17 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 123.386 0.674 . . . . 0.0 110.296 -178.667 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 47.9 mm-40 -60.41 -48.31 82.32 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 124.078 0.951 . . . . 0.0 110.592 178.756 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 16.6 mm100 -54.23 -55.83 24.27 Favored 'General case' 0 C--N 1.341 0.21 0 C-N-CA 124.502 1.121 . . . . 0.0 110.557 179.726 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 62.0 mm-40 -59.35 -39.57 83.62 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 124.015 0.926 . . . . 0.0 111.63 179.25 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 9.7 mmm180 -58.95 -56.91 16.11 Favored 'General case' 0 N--CA 1.456 -0.167 0 CA-C-N 118.143 0.428 . . . . 0.0 110.909 176.406 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 19.8 ptt180 -66.07 -30.69 71.25 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 112.557 0.577 . . . . 0.0 112.557 -177.582 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 15.5 m-85 -58.69 -52.01 67.52 Favored 'General case' 0 C--N 1.343 0.311 0 CA-C-N 118.494 0.588 . . . . 0.0 110.344 169.874 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 47.5 t80 -58.37 -48.65 79.94 Favored 'General case' 0 C--N 1.341 0.203 0 C-N-CA 122.994 0.517 . . . . 0.0 110.657 -179.807 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -56.99 -46.99 81.87 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 123.355 0.662 . . . . 0.0 111.03 -179.742 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.62 -54.09 44.82 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 123.402 0.681 . . . . 0.0 111.514 178.716 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 61.3 tp -59.86 -45.77 91.39 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 124.572 1.149 . . . . 0.0 111.215 -176.428 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 22.9 m-70 -89.28 16.24 7.71 Favored 'General case' 0 CA--C 1.537 0.481 0 C-N-CA 124.309 1.043 . . . . 0.0 111.994 -179.617 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -68.22 135.45 91.33 Favored Pre-proline 0 CA--C 1.533 0.311 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 172.863 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -67.67 -29.16 36.61 Favored 'Trans proline' 0 N--CA 1.457 -0.651 0 C-N-CA 122.456 2.104 . . . . 0.0 112.668 -176.39 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 27.5 m-80 -83.1 62.88 6.84 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.685 0.794 . . . . 0.0 110.516 -175.884 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 20.7 mt -80.3 87.1 5.6 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-O 121.683 0.754 . . . . 0.0 110.234 177.794 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 52.3 p-10 -98.7 17.36 19.47 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 125.602 1.561 . . . . 0.0 110.775 171.413 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.9 mp0 71.46 -55.98 0.64 Allowed 'General case' 0 C--N 1.345 0.408 0 C-N-CA 127.223 2.209 . . . . 0.0 111.277 -174.035 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -45.24 -54.03 7.55 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 126.246 1.819 . . . . 0.0 112.219 -178.191 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 37.1 mt-30 -60.52 -54.13 49.15 Favored 'General case' 0 C--N 1.34 0.176 0 C-N-CA 123.301 0.641 . . . . 0.0 110.56 -176.34 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 78.3 ttt180 -54.33 -56.19 20.99 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 124.117 0.967 . . . . 0.0 110.998 -179.253 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 11.4 m-80 -59.74 -50.3 74.38 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 122.939 0.495 . . . . 0.0 110.854 -177.537 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -54.64 -50.21 68.69 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 123.262 0.625 . . . . 0.0 111.409 -179.828 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 27.1 mmmt -61.39 -54.02 49.1 Favored 'General case' 0 N--CA 1.454 -0.225 0 C-N-CA 122.769 0.428 . . . . 0.0 110.83 179.603 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 39.7 mt -54.87 -46.53 75.68 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 C-N-CA 123.282 0.633 . . . . 0.0 110.999 -178.159 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 60.9 mtpt -58.16 -48.25 80.85 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 123.888 0.875 . . . . 0.0 110.972 176.227 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 50.3 m -58.29 -52.7 64.49 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 117.917 0.326 . . . . 0.0 111.121 179.13 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 41.1 mt -63.37 -49.06 84.38 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.251 0 C-N-CA 124.312 1.045 . . . . 0.0 110.751 -173.891 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 12.3 ptm180 -64.81 -34.79 79.2 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 118.018 0.372 . . . . 0.0 111.634 -177.087 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 84.1 m-20 -68.54 -48.62 63.84 Favored 'General case' 0 C--N 1.341 0.237 0 C-N-CA 122.761 0.424 . . . . 0.0 110.235 175.539 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 34.3 t70 . . . . . 0 C--O 1.251 1.178 0 CA-C-O 117.459 -1.258 . . . . 0.0 109.403 178.522 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.762 0 N-CA-C 111.72 0.267 . . . . 0.0 111.72 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 22.8 t -72.24 81.26 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.353 0 C-N-CA 123.831 0.852 . . . . 0.0 109.013 179.467 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -152.02 -67.57 0.17 Allowed 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 124.677 1.191 . . . . 0.0 108.817 -179.738 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.86 58.07 2.75 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.19 0.996 . . . . 0.0 110.838 178.16 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 59.0 m -130.79 54.85 1.87 Allowed 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 107.007 -1.479 . . . . 0.0 107.007 -178.589 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 18.0 m-85 -79.51 69.78 5.84 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 124.931 1.292 . . . . 0.0 108.475 -179.06 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 10.6 m120 -77.84 54.79 1.31 Allowed 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 125.271 1.428 . . . . 0.0 112.706 -169.899 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 62.6 mtt -149.21 -52.75 0.16 Allowed 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 128.726 2.81 . . . . 0.0 105.737 174.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 48.3 mt-30 -64.12 -56.74 12.73 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 125.343 1.457 . . . . 0.0 108.499 169.679 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 90.0 mt-30 -64.39 -20.74 66.33 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 125.537 1.535 . . . . 0.0 112.154 176.617 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 11.5 tt0 -60.23 -32.56 71.24 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 118.876 0.762 . . . . 0.0 111.398 177.254 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 5.1 mmp_? -64.14 -47.02 81.53 Favored 'General case' 0 N--CA 1.456 -0.151 0 C-N-CA 123.245 0.618 . . . . 0.0 110.12 173.858 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 79.4 mtt85 -60.49 -44.33 96.07 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 123.42 0.688 . . . . 0.0 110.139 178.151 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 14.1 m-30 -57.67 -45.71 85.23 Favored 'General case' 0 C--O 1.225 -0.215 0 C-N-CA 123.562 0.745 . . . . 0.0 111.592 174.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 87.0 t80 -58.43 -52.27 66.34 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 118.648 0.658 . . . . 0.0 110.373 178.795 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -56.9 -52.41 65.25 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.564 0.746 . . . . 0.0 111.178 179.841 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.23 -51.13 70.87 Favored 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 124.739 1.216 . . . . 0.0 111.555 -178.004 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 59.6 tp -62.11 -50.2 72.87 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 124.541 1.136 . . . . 0.0 110.34 -177.548 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 18.0 m-70 -82.17 62.78 6.06 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.8 0.84 . . . . 0.0 109.674 178.008 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -154.43 121.93 2.89 Favored Pre-proline 0 CA--C 1.535 0.371 0 C-N-CA 123.916 0.886 . . . . 0.0 109.414 176.491 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo -80.06 -32.75 1.31 Allowed 'Trans proline' 0 N--CA 1.456 -0.735 0 C-N-CA 123.458 2.772 . . . . 0.0 112.319 -178.311 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 30.3 t30 -53.52 -47.88 69.52 Favored 'General case' 0 C--N 1.343 0.298 0 C-N-CA 124.231 1.012 . . . . 0.0 110.923 -176.246 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -75.87 88.51 2.88 Favored 'General case' 0 N--CA 1.455 -0.219 0 N-CA-C 105.272 -2.121 . . . . 0.0 105.272 169.5 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 -81.69 55.45 2.7 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.532 1.133 . . . . 0.0 112.811 -169.639 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 15.3 tt0 69.88 164.94 0.27 Allowed 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.879 1.272 . . . . 0.0 110.969 -179.353 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.9 tp10 71.8 -64.01 0.4 Allowed 'General case' 0 N--CA 1.456 -0.163 0 C-N-CA 127.031 2.132 . . . . 0.0 110.775 -178.033 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 33.4 mm-40 -59.58 -45.39 92.02 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 124.341 1.057 . . . . 0.0 109.631 171.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 39.3 ttp180 -56.13 -53.32 58.51 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 125.684 1.594 . . . . 0.0 110.513 176.934 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 9.8 m120 -61.81 -43.45 98.82 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 124.467 1.107 . . . . 0.0 110.742 -179.579 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -60.83 -51.23 70.18 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 124.081 0.952 . . . . 0.0 111.206 -178.541 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 61.1 pttt -66.52 -34.9 78.95 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 118.345 0.52 . . . . 0.0 111.594 -178.101 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 5.3 mt -58.95 -48.08 87.67 Favored 'Isoleucine or valine' 0 C--N 1.342 0.251 0 CA-C-O 118.962 -0.542 . . . . 0.0 109.84 170.407 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 52.0 tptt -60.95 -37.32 81.93 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 118.754 0.706 . . . . 0.0 111.435 179.228 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 19.4 m -59.61 -41.63 90.78 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 118.507 0.594 . . . . 0.0 111.188 174.948 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 70.7 mt -65.61 -60.61 2.44 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.453 0 C-N-CA 123.831 0.852 . . . . 0.0 109.709 177.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 3.5 ptm180 -92.09 69.47 5.31 Favored 'General case' 0 C--N 1.341 0.219 0 C-N-CA 123.783 0.833 . . . . 0.0 110.191 174.197 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -82.1 59.84 4.6 Favored 'General case' 0 CA--C 1.532 0.253 0 N-CA-C 109.91 -0.404 . . . . 0.0 109.91 178.954 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 . . . . . 0 C--O 1.251 1.15 0 CA-C-O 117.517 -1.23 . . . . 0.0 110.645 -179.092 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 0.718 0 N-CA-C 111.921 0.341 . . . . 0.0 111.921 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 35.3 m -65.39 159.64 3.97 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 C-N-CA 123.603 0.761 . . . . 0.0 110.937 179.033 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -79.39 64.32 4.25 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 124.121 0.968 . . . . 0.0 111.083 -177.269 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 64.1 tp60 -153.52 57.96 0.75 Allowed 'General case' 0 N--CA 1.454 -0.268 0 N-CA-C 107.464 -1.309 . . . . 0.0 107.464 173.308 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 87.3 p -138.11 47.55 2.01 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 124.914 1.286 . . . . 0.0 107.959 -176.896 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 9.4 m-85 -80.23 67.6 6.11 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 124.81 1.244 . . . . 0.0 108.101 178.58 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 36.5 p-10 -30.7 -56.61 0.21 Allowed 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 126.794 2.038 . . . . 0.0 114.576 -173.325 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 96.4 mtp -80.88 58.74 3.48 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.346 1.058 . . . . 0.0 110.823 179.89 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 23.2 tt0 177.55 -57.9 0.01 OUTLIER 'General case' 0 CA--C 1.529 0.147 0 C-N-CA 127.755 2.422 . . . . 0.0 106.352 -178.259 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 29.1 mm100 -54.08 -34.88 61.32 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 125.218 1.407 . . . . 0.0 112.012 176.686 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -36.42 -41.11 0.27 Allowed 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 125.937 1.695 . . . . 0.0 114.204 177.673 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 33.3 tpt85 -69.97 -53.98 15.33 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.352 0.661 . . . . 0.0 111.075 -178.738 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 9.8 mpt_? -61.47 -47.29 86.37 Favored 'General case' 0 CA--C 1.53 0.212 0 C-N-CA 124.446 1.098 . . . . 0.0 109.577 -178.912 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 88.4 t80 -49.42 -51.64 33.96 Favored 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 127.709 2.403 . . . . 0.0 111.33 172.67 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 40.7 t80 -58.41 -47.41 84.01 Favored 'General case' 0 C--N 1.341 0.197 0 CA-C-O 119.019 -0.515 . . . . 0.0 110.803 177.388 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 46.4 mm-40 -58.43 -51.69 68.75 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 118.68 0.673 . . . . 0.0 110.69 178.909 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -56.45 -45.59 80.76 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 124.374 1.07 . . . . 0.0 111.72 -178.994 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 57.7 tp -64.87 -53.47 46.11 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 123.9 0.88 . . . . 0.0 110.384 178.506 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 16.8 m-70 -82.28 57.99 3.86 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 124.643 1.177 . . . . 0.0 109.877 -179.782 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -156.51 78.02 4.15 Favored Pre-proline 0 CA--C 1.534 0.356 0 C-N-CA 124.904 1.282 . . . . 0.0 107.79 178.266 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -82.47 59.08 6.78 Favored 'Trans proline' 0 N--CA 1.456 -0.683 0 C-N-CA 124.323 3.349 . . . . 0.0 110.568 -172.659 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 3.1 p-10 -154.47 -30.9 0.11 Allowed 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 124.806 1.242 . . . . 0.0 111.556 -176.372 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -62.83 153.61 32.55 Favored 'General case' 0 C--N 1.343 0.293 0 CA-C-N 118.742 0.701 . . . . 0.0 109.995 170.782 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 8.9 p30 -65.92 132.48 48.73 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 175.247 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -80.76 65.27 5.84 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 124.276 1.03 . . . . 0.0 108.585 -178.295 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.9 tp10 -152.07 -52.59 0.12 Allowed 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 126.805 2.042 . . . . 0.0 106.636 179.515 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 35.0 mt-30 -63.62 -65.45 0.68 Allowed 'General case' 0 C--N 1.341 0.218 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 171.678 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 18.7 ptt180 -61.59 -33.62 74.2 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-O 119.075 -0.488 . . . . 0.0 111.728 178.266 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 24.5 t-20 -63.88 -49.4 72.87 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 118.482 0.583 . . . . 0.0 111.191 179.031 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.34 -47.55 83.42 Favored 'General case' 0 C--N 1.339 0.15 0 C-N-CA 123.552 0.741 . . . . 0.0 110.864 178.159 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 57.8 mtpt -56.36 -61.19 2.57 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 123.51 0.724 . . . . 0.0 110.176 177.266 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 38.5 mt -49.89 -53.0 11.85 Favored 'Isoleucine or valine' 0 C--N 1.338 0.076 0 C-N-CA 124.946 1.298 . . . . 0.0 110.994 -178.843 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 6.9 ttpm? -53.37 -54.05 42.3 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 124.429 1.092 . . . . 0.0 111.311 178.86 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 51.0 m -56.82 -48.12 78.72 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 122.656 0.382 . . . . 0.0 111.647 179.883 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 67.4 mt -62.27 -50.83 78.39 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.267 0 C-N-CA 124.314 1.046 . . . . 0.0 110.697 -175.278 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 36.2 ptt85 -71.93 -31.85 66.77 Favored 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 112.484 0.55 . . . . 0.0 112.484 -177.301 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 87.6 m-20 -69.3 -45.25 70.04 Favored 'General case' 0 C--N 1.341 0.226 0 CA-C-N 118.212 0.46 . . . . 0.0 110.855 178.689 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 . . . . . 0 C--O 1.251 1.161 0 CA-C-O 116.728 -1.606 . . . . 0.0 110.287 -175.691 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 0.689 0 N-CA-C 111.73 0.27 . . . . 0.0 111.73 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 21.9 t -78.49 72.23 0.54 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 C-N-CA 124.104 0.961 . . . . 0.0 108.718 -179.737 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -165.33 -68.26 0.03 OUTLIER 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 125.767 1.627 . . . . 0.0 107.106 178.365 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -83.8 63.48 7.52 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.829 0.852 . . . . 0.0 109.086 171.113 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 23.0 t -136.67 56.74 1.79 Allowed 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 107.346 -1.353 . . . . 0.0 107.346 178.736 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 24.3 m-85 -79.82 70.4 6.35 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 124.895 1.278 . . . . 0.0 108.369 179.323 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -61.84 66.11 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 127.714 2.405 . . . . 0.0 115.247 -169.708 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 37.2 tpp -179.39 -45.88 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 128.638 2.775 . . . . 0.0 107.185 179.22 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 28.3 mp0 -75.74 -43.3 47.48 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 125.757 1.623 . . . . 0.0 109.404 173.206 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 12.5 mm100 -49.65 -41.58 43.07 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 125.654 1.582 . . . . 0.0 111.157 173.712 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 82.2 mt-30 -53.35 -42.49 66.87 Favored 'General case' 0 C--N 1.34 0.182 0 C-N-CA 124.317 1.047 . . . . 0.0 111.337 177.362 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 80.4 mmt-85 -64.26 -42.05 96.65 Favored 'General case' 0 N--CA 1.456 -0.165 0 C-N-CA 123.4 0.68 . . . . 0.0 110.611 -178.16 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.48 -40.25 95.32 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-O 119.546 -0.264 . . . . 0.0 110.54 173.951 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 20.6 m-85 -62.66 -34.07 76.34 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-O 118.716 -0.659 . . . . 0.0 111.496 175.673 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 19.5 m-85 -76.72 55.12 1.03 Allowed 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 119.075 0.852 . . . . 0.0 110.342 172.449 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -178.56 -55.93 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 127.183 2.193 . . . . 0.0 107.676 -179.034 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -80.53 -47.52 14.12 Favored 'General case' 0 C--N 1.34 0.185 0 C-N-CA 123.951 0.9 . . . . 0.0 111.579 -179.366 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.0 tt -78.01 -56.49 4.44 Favored 'General case' 0 C--N 1.338 0.072 0 N-CA-C 107.956 -1.127 . . . . 0.0 107.956 -178.079 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 62.7 m-70 -84.45 54.41 2.99 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 124.422 1.089 . . . . 0.0 109.392 176.95 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -87.45 141.55 32.46 Favored Pre-proline 0 CA--C 1.533 0.318 0 C-N-CA 123.649 0.779 . . . . 0.0 109.785 -179.818 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_exo -43.52 -59.97 0.9 Allowed 'Trans proline' 0 N--CA 1.455 -0.771 0 C-N-CA 124.212 3.275 . . . . 0.0 115.343 173.015 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 9.4 p30 -157.53 25.91 0.29 Allowed 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 115.001 1.482 . . . . 0.0 115.001 -169.969 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 28.5 mt -63.1 133.24 54.14 Favored 'General case' 0 C--N 1.34 0.182 0 CA-C-N 119.647 1.112 . . . . 0.0 109.375 169.974 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 14.2 p30 -65.05 163.82 14.05 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 123.715 0.806 . . . . 0.0 110.527 175.847 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -51.48 -49.11 62.46 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 124.05 0.94 . . . . 0.0 112.314 -175.046 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -58.2 -57.23 13.79 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.312 0.645 . . . . 0.0 110.959 -177.331 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 92.0 mm-40 -66.62 -43.47 84.67 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 123.073 0.549 . . . . 0.0 111.495 -175.217 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 22.3 ttm-85 -56.02 -54.55 43.54 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.761 0.824 . . . . 0.0 109.619 175.889 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -57.17 -40.7 77.81 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 123.877 0.871 . . . . 0.0 111.624 178.282 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -60.42 -45.59 93.07 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 123.061 0.544 . . . . 0.0 111.088 178.429 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 12.3 mmmm -58.75 -47.48 84.51 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 122.591 0.356 . . . . 0.0 110.707 175.56 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 48.2 mm -57.15 -44.49 83.42 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 CA-C-N 117.949 0.34 . . . . 0.0 110.701 177.007 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 1.3 tppm? -61.4 -39.87 92.3 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 123.529 0.732 . . . . 0.0 111.015 178.23 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 20.1 m -60.66 -42.07 96.27 Favored 'General case' 0 CA--C 1.533 0.302 0 O-C-N 121.732 -0.605 . . . . 0.0 111.187 175.301 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 43.2 mt -72.1 -40.37 66.67 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 C-N-CA 124.103 0.961 . . . . 0.0 111.44 -177.052 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 12.2 ptt180 -133.38 91.88 2.92 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 124.424 1.09 . . . . 0.0 108.244 174.477 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 17.5 p-10 -65.48 72.39 0.05 Allowed 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 125.946 1.699 . . . . 0.0 112.589 178.261 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 31.3 t70 . . . . . 0 C--O 1.251 1.163 0 C-N-CA 125.869 1.667 . . . . 0.0 108.072 176.431 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 0.619 0 CA-C-O 120.239 0.066 . . . . 0.0 110.887 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 30.0 m -85.63 -158.27 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.409 0 C-N-CA 124.078 0.951 . . . . 0.0 108.861 174.419 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -75.54 72.24 2.51 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 123.662 0.785 . . . . 0.0 110.574 178.427 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 25.1 mt-30 -95.81 -65.82 0.95 Allowed 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 124.627 1.171 . . . . 0.0 109.081 -179.066 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 55.0 m -100.31 -123.27 0.16 Allowed 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.835 1.254 . . . . 0.0 108.564 178.99 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -75.16 65.06 1.49 Allowed 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.853 1.261 . . . . 0.0 112.138 176.67 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 33.6 p-10 -18.99 -62.96 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 129.558 3.143 . . . . 0.0 117.22 -175.616 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 76.9 mtm -64.59 -48.08 76.27 Favored 'General case' 0 CA--C 1.529 0.152 0 C-N-CA 123.642 0.777 . . . . 0.0 110.791 -174.876 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 4.3 mp0 -64.88 -36.84 85.66 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 124.282 1.033 . . . . 0.0 110.022 176.498 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 44.3 tt0 -61.02 -64.98 0.77 Allowed 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 124.283 1.033 . . . . 0.0 110.503 -178.721 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 18.5 pt20 -59.41 -30.64 68.61 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 123.916 0.887 . . . . 0.0 111.789 -179.561 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 49.5 ttt-85 -66.1 -59.33 3.88 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.832 0.853 . . . . 0.0 110.999 177.278 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 22.8 mtp-105 -56.52 -38.15 71.42 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 124.748 1.219 . . . . 0.0 111.124 177.382 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 23.5 t80 -60.9 -53.46 56.98 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 125.61 1.564 . . . . 0.0 110.824 178.021 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 45.0 t80 -57.11 -49.12 76.88 Favored 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 123.806 0.842 . . . . 0.0 110.11 177.203 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 5.9 tm-20 -53.45 -57.21 11.46 Favored 'General case' 0 C--N 1.341 0.199 0 C-N-CA 123.549 0.74 . . . . 0.0 109.978 178.47 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -53.49 -55.66 23.5 Favored 'General case' 0 N--CA 1.456 -0.174 0 C-N-CA 124.052 0.941 . . . . 0.0 111.232 -178.084 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 63.3 tp -59.1 -54.65 44.6 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 124.462 1.105 . . . . 0.0 111.754 -176.467 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 21.3 m-70 -70.95 -37.78 72.84 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 122.956 0.502 . . . . 0.0 112.11 -173.532 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -67.86 120.63 75.17 Favored Pre-proline 0 CA--C 1.535 0.386 0 CA-C-O 118.957 -0.544 . . . . 0.0 110.737 -176.237 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 75.4 Cg_endo -80.62 -29.74 2.17 Favored 'Trans proline' 0 N--CA 1.455 -0.775 0 C-N-CA 123.39 2.727 . . . . 0.0 111.872 179.313 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 14.6 m120 -58.66 -34.79 71.61 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 125.062 1.345 . . . . 0.0 113.001 -170.803 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 85.6 mt -55.21 135.06 49.92 Favored 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 173.974 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 30.2 p-10 -83.59 48.08 1.37 Allowed 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 123.768 0.827 . . . . 0.0 112.683 -169.894 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 5.6 tm-20 70.81 -64.02 0.39 Allowed 'General case' 0 C--N 1.342 0.28 0 C-N-CA 126.071 1.748 . . . . 0.0 112.201 177.456 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 24.9 pt-20 -54.61 -44.88 73.49 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.89 0.876 . . . . 0.0 112.182 -174.893 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 45.1 mt-30 -64.24 -52.2 59.92 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 123.295 0.638 . . . . 0.0 110.671 178.296 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 26.5 ttp-105 -52.29 -47.85 65.66 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 124.765 1.226 . . . . 0.0 111.354 178.726 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 4.8 m-80 -70.98 -40.29 71.98 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 123.607 0.763 . . . . 0.0 111.379 -178.847 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -59.89 -45.49 92.33 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.251 0.62 . . . . 0.0 111.065 177.413 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 8.3 mmmm -56.1 -58.5 7.65 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 123.684 0.794 . . . . 0.0 109.44 174.013 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 50.8 mt -55.02 -53.43 34.14 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.275 0 C-N-CA 124.392 1.077 . . . . 0.0 112.209 -175.246 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.65 -43.03 97.96 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 118.557 0.617 . . . . 0.0 111.147 -176.553 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 30.4 t -58.41 -50.95 71.86 Favored 'General case' 0 C--N 1.342 0.263 0 C-N-CA 123.448 0.699 . . . . 0.0 110.211 178.071 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 48.5 mt -55.1 -48.49 76.02 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.189 0 C-N-CA 125.228 1.411 . . . . 0.0 110.894 177.86 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -60.09 -50.78 72.34 Favored 'General case' 0 N--CA 1.455 -0.181 0 CA-C-O 119.187 -0.435 . . . . 0.0 111.208 179.902 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -70.86 -24.54 62.53 Favored 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 113.297 0.851 . . . . 0.0 113.297 -177.979 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 32.7 t70 . . . . . 0 C--O 1.252 1.191 0 CA-C-O 117.052 -1.451 . . . . 0.0 109.946 -178.207 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.742 0 CA-C-O 120.687 0.279 . . . . 0.0 111.168 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 58.2 t -76.73 88.62 0.87 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 N-CA-C 108.364 -0.976 . . . . 0.0 108.364 179.757 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -74.74 -61.23 1.95 Allowed 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 123.997 0.919 . . . . 0.0 109.965 -179.724 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 1.7 pp0? -83.48 169.48 15.45 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 123.386 0.674 . . . . 0.0 110.825 177.042 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 87.4 p -136.93 43.17 2.4 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 124.508 1.123 . . . . 0.0 108.891 171.776 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 6.7 t80 -96.19 -46.77 6.32 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 125.082 1.353 . . . . 0.0 108.445 -179.784 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 39.9 t-20 -73.07 76.19 1.23 Allowed 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 124.563 1.145 . . . . 0.0 108.055 169.766 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 26.6 ttt -177.76 -55.08 0.01 OUTLIER 'General case' 0 N--CA 1.455 -0.208 0 C-N-CA 127.664 2.386 . . . . 0.0 105.031 -170.019 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 42.8 mt-30 -67.78 -52.13 40.77 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 105.895 -1.891 . . . . 0.0 105.895 169.198 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 95.4 mt-30 -82.04 82.93 7.45 Favored 'General case' 0 N--CA 1.448 -0.525 0 C-N-CA 125.301 1.44 . . . . 0.0 107.938 169.834 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 21.5 tp60 -116.44 -51.88 2.59 Favored 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 124.684 1.193 . . . . 0.0 108.514 174.129 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 13.8 tpt180 -65.31 -55.01 20.7 Favored 'General case' 0 C--N 1.34 0.189 0 C-N-CA 123.25 0.62 . . . . 0.0 109.84 174.032 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 81.5 mtp180 -52.66 -47.23 67.26 Favored 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 124.295 1.038 . . . . 0.0 110.521 178.382 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 8.7 t80 -61.48 -52.45 64.47 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 125.838 1.655 . . . . 0.0 112.095 179.362 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 91.1 t80 -58.26 -43.98 88.17 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 124.341 1.056 . . . . 0.0 110.631 178.54 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -63.78 -43.76 95.38 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.092 0.957 . . . . 0.0 110.849 177.92 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.49 -42.37 98.7 Favored 'General case' 0 C--N 1.341 0.225 0 C-N-CA 123.873 0.869 . . . . 0.0 111.188 176.766 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 58.4 tp -59.46 -51.59 69.23 Favored 'General case' 0 N--CA 1.454 -0.239 0 C-N-CA 123.414 0.685 . . . . 0.0 109.557 176.768 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 22.0 m-70 -93.84 49.52 1.35 Allowed 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 123.881 0.872 . . . . 0.0 110.774 -178.321 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -71.59 165.36 49.81 Favored Pre-proline 0 CA--C 1.539 0.543 0 CA-C-O 118.977 -0.535 . . . . 0.0 110.309 177.35 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -55.49 -65.82 0.1 Allowed 'Trans proline' 0 N--CA 1.457 -0.636 0 C-N-CA 123.148 2.565 . . . . 0.0 112.742 179.944 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 17.3 t-20 -167.73 70.32 0.09 Allowed 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 123.583 0.753 . . . . 0.0 109.762 -179.744 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -79.91 163.8 24.04 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 172.469 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 50.7 p-10 -79.87 17.87 0.89 Allowed 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 114.328 1.233 . . . . 0.0 114.328 -169.967 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 13.5 tp10 71.58 -44.92 0.6 Allowed 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 126.17 1.788 . . . . 0.0 113.187 -176.423 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 14.7 tp10 -57.22 -51.46 69.25 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 119.09 0.859 . . . . 0.0 110.638 178.072 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 45.7 mt-30 -62.15 -46.28 89.66 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 124.041 0.936 . . . . 0.0 111.151 178.883 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 45.9 ttm180 -55.42 -51.29 67.35 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 124.607 1.163 . . . . 0.0 110.402 178.455 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 47.6 t30 -61.5 -51.14 69.88 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 124.52 1.128 . . . . 0.0 110.396 179.54 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -54.51 -45.89 73.39 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 124.091 0.957 . . . . 0.0 111.743 -179.647 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 54.6 mmtt -55.62 -53.33 57.82 Favored 'General case' 0 C--N 1.34 0.169 0 C-N-CA 123.095 0.558 . . . . 0.0 110.214 173.06 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 89.9 mt -60.64 -35.21 62.19 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 C-N-CA 123.155 0.582 . . . . 0.0 111.866 -176.263 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 64.1 mttm -63.04 -48.41 78.81 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 119.162 0.892 . . . . 0.0 110.07 170.556 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 15.0 m -74.59 3.28 8.01 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 124.432 1.093 . . . . 0.0 113.459 -178.606 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 57.5 mt -107.85 -61.5 2.48 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.237 0 N-CA-C 106.867 -1.531 . . . . 0.0 106.867 171.543 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 19.7 tpp180 -81.4 68.96 7.93 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 125.187 1.395 . . . . 0.0 108.843 174.948 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -82.18 62.6 5.98 Favored 'General case' 0 CA--C 1.531 0.236 0 N-CA-C 108.501 -0.925 . . . . 0.0 108.501 174.814 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 11.6 t70 . . . . . 0 C--O 1.251 1.137 0 CA-C-O 117.184 -1.388 . . . . 0.0 110.37 -169.904 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.778 0 N-CA-C 111.74 0.274 . . . . 0.0 111.74 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 8.3 p -62.83 128.08 24.1 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.343 0 C-N-CA 123.77 0.828 . . . . 0.0 110.871 -177.718 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -81.7 67.44 7.68 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 124.438 1.095 . . . . 0.0 111.336 -174.412 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 87.7 mt-30 -71.86 -61.8 1.65 Allowed 'General case' 0 N--CA 1.456 -0.158 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 173.003 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 38.0 t -162.03 55.92 0.24 Allowed 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 124.152 0.981 . . . . 0.0 109.009 176.527 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 36.4 t80 -158.42 -58.15 0.07 Allowed 'General case' 0 C--N 1.34 0.152 0 C-N-CA 123.084 0.554 . . . . 0.0 110.957 178.308 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 21.0 m120 -78.68 63.61 3.49 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 123.97 0.908 . . . . 0.0 110.852 -173.84 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 26.7 ttt -169.83 -56.69 0.02 OUTLIER 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 126.959 2.104 . . . . 0.0 106.5 -175.144 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 22.0 mm100 -65.62 -38.95 90.87 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 123.93 0.892 . . . . 0.0 109.421 171.016 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 36.0 tt0 -49.58 -63.11 1.21 Allowed 'General case' 0 C--N 1.341 0.22 0 C-N-CA 124.848 1.259 . . . . 0.0 109.344 169.769 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 67.6 mt-30 -46.29 -33.8 4.02 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 125.861 1.664 . . . . 0.0 113.124 -169.957 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 44.8 mtt180 -56.34 -72.86 0.07 Allowed 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.446 1.098 . . . . 0.0 111.416 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -64.39 -38.38 90.82 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 124.284 1.033 . . . . 0.0 110.923 -178.743 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 49.2 t80 -59.43 -53.31 59.61 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 126.23 1.812 . . . . 0.0 110.966 -177.594 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 47.7 t80 -62.49 -45.04 94.82 Favored 'General case' 0 C--N 1.341 0.227 0 C-N-CA 123.562 0.745 . . . . 0.0 110.284 175.794 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 15.8 tp10 -55.74 -49.39 73.21 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 122.549 0.339 . . . . 0.0 110.866 -179.097 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.24 -51.46 68.85 Favored 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 123.8 0.84 . . . . 0.0 111.165 179.083 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 57.7 tp -60.65 -57.75 11.38 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 123.915 0.886 . . . . 0.0 111.2 -176.905 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 29.0 m-70 -83.41 61.81 6.39 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 124.738 1.215 . . . . 0.0 109.765 -178.659 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -158.6 120.27 1.93 Allowed Pre-proline 0 CA--C 1.533 0.326 0 C-N-CA 123.911 0.884 . . . . 0.0 109.061 177.69 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -77.9 -27.65 5.68 Favored 'Trans proline' 0 N--CA 1.455 -0.736 0 C-N-CA 123.316 2.677 . . . . 0.0 112.01 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -54.71 -53.68 51.8 Favored 'General case' 0 C--N 1.344 0.341 0 C-N-CA 123.711 0.804 . . . . 0.0 110.218 -179.335 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 81.1 mt -71.03 121.53 18.38 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 107.146 -1.428 . . . . 0.0 107.146 169.625 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 25.3 p30 -72.57 175.54 6.24 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-O 120.749 0.309 . . . . 0.0 110.742 -177.747 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -59.2 -51.39 70.18 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 123.186 0.594 . . . . 0.0 111.972 -171.729 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -62.77 -38.53 90.99 Favored 'General case' 0 CA--C 1.534 0.34 0 N-CA-C 111.867 0.321 . . . . 0.0 111.867 -179.551 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 85.5 mt-30 -62.28 -56.46 18.29 Favored 'General case' 0 C--N 1.34 0.163 0 C-N-CA 123.496 0.718 . . . . 0.0 110.823 178.523 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 31.6 ptt180 -66.29 -32.11 73.33 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 112.098 0.407 . . . . 0.0 112.098 -177.578 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 72.6 m-20 -64.93 -40.01 94.38 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 118.226 0.466 . . . . 0.0 110.864 172.224 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -63.38 -44.4 94.83 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 118.057 0.39 . . . . 0.0 110.669 175.953 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 11.9 mmmm -55.41 -51.49 66.69 Favored 'General case' 0 C--N 1.341 0.223 0 C-N-CA 123.237 0.615 . . . . 0.0 110.439 174.642 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 33.9 mt -51.74 -53.28 17.7 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.189 0 C-N-CA 123.404 0.682 . . . . 0.0 110.327 175.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 82.2 tttt -65.01 -25.84 68.03 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.039 0.535 . . . . 0.0 112.316 -177.359 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 49.5 m -74.34 -46.96 37.37 Favored 'General case' 0 CA--C 1.529 0.16 0 CA-C-N 118.691 0.678 . . . . 0.0 110.716 175.727 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 40.8 mt -63.72 -62.13 1.35 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.261 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 179.197 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 52.1 ttp85 -78.88 75.89 5.38 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 125.335 1.454 . . . . 0.0 107.72 170.09 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -61.68 76.3 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 127.336 2.254 . . . . 0.0 112.529 -178.129 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 19.2 t70 . . . . . 0 C--O 1.25 1.131 0 C-N-CA 125.5 1.52 . . . . 0.0 108.631 178.263 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.755 0 N-CA-C 111.643 0.238 . . . . 0.0 111.643 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 22.1 t -82.28 67.22 0.49 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 N-CA-C 108.25 -1.018 . . . . 0.0 108.25 179.664 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -84.6 86.61 7.29 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 124.357 1.063 . . . . 0.0 109.872 -175.86 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 36.6 mm-40 -77.07 71.69 3.58 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 123.711 0.804 . . . . 0.0 109.952 -179.892 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 40.8 p -158.49 53.19 0.43 Allowed 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 125.025 1.33 . . . . 0.0 108.113 -178.343 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 49.4 m-85 -80.22 76.24 7.0 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 124.085 0.954 . . . . 0.0 110.13 -173.438 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 24.8 t-20 -40.68 -54.04 2.67 Favored 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 126.332 1.853 . . . . 0.0 112.781 -178.723 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 97.4 mtp -60.47 -47.76 84.7 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 123.556 0.742 . . . . 0.0 111.566 -177.061 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 20.4 tt0 -57.9 -62.72 1.61 Allowed 'General case' 0 C--N 1.34 0.167 0 C-N-CA 123.8 0.84 . . . . 0.0 109.74 177.723 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.4 mp0 -48.42 -51.07 28.48 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 125.323 1.449 . . . . 0.0 111.314 -179.967 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 22.6 tt0 -54.33 -43.25 71.05 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 125.188 1.395 . . . . 0.0 111.635 176.473 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.48 -58.45 7.97 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 124.157 0.983 . . . . 0.0 109.488 177.226 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -61.39 -38.45 87.07 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-O 118.932 -0.556 . . . . 0.0 111.917 -178.933 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 25.1 m-85 -61.49 -43.79 98.24 Favored 'General case' 0 C--N 1.342 0.241 0 CA-C-N 118.999 0.818 . . . . 0.0 110.917 177.733 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 53.5 t80 -60.16 -46.74 88.64 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 118.082 0.401 . . . . 0.0 110.094 175.112 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 15.5 tp10 -56.38 -45.15 80.67 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 117.95 0.341 . . . . 0.0 110.876 177.934 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.15 -53.73 48.79 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 124.341 1.056 . . . . 0.0 111.336 -178.677 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 58.7 mt -61.95 -54.27 44.14 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 123.5 0.72 . . . . 0.0 110.575 -178.686 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 29.0 m-70 -85.1 66.21 9.63 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.265 1.026 . . . . 0.0 109.276 -177.82 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -127.46 140.34 37.72 Favored Pre-proline 0 CA--C 1.536 0.409 0 C-N-CA 125.743 1.617 . . . . 0.0 108.531 -178.544 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -76.89 -38.73 0.78 Allowed 'Trans proline' 0 N--CA 1.457 -0.636 0 C-N-CA 123.085 2.523 . . . . 0.0 112.841 -178.872 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 35.3 m120 -81.16 74.04 8.18 Favored 'General case' 0 C--N 1.34 0.185 0 C-N-CA 124.262 1.025 . . . . 0.0 110.498 -173.547 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 33.2 mt -98.86 140.14 33.48 Favored 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 112.937 0.717 . . . . 0.0 112.937 -174.762 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 52.1 p-10 -153.79 12.53 0.45 Allowed 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 126.561 1.944 . . . . 0.0 110.197 169.683 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 18.7 tp10 67.02 -47.5 0.47 Allowed 'General case' 0 C--N 1.346 0.449 0 C-N-CA 128.105 2.562 . . . . 0.0 113.177 -171.176 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 5.2 tm-20 -49.05 -45.21 42.52 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 124.789 1.235 . . . . 0.0 111.882 177.637 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 49.4 mm-40 -65.09 -41.54 94.88 Favored 'General case' 0 C--N 1.34 0.192 0 N-CA-C 109.902 -0.407 . . . . 0.0 109.902 -179.438 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 4.4 mmp_? -59.68 -61.85 2.31 Favored 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 177.492 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 17.4 t-20 -45.96 -50.18 15.04 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 126.128 1.771 . . . . 0.0 111.947 -177.878 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -55.7 -44.99 77.91 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 124.182 0.993 . . . . 0.0 111.595 176.259 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 26.1 mtpp -69.4 -42.08 75.56 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-O 118.432 -0.794 . . . . 0.0 111.777 179.635 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 10.3 mm -54.67 -53.97 27.13 Favored 'Isoleucine or valine' 0 C--N 1.345 0.377 0 CA-C-N 119.452 1.024 . . . . 0.0 110.144 -176.385 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 9.8 ptpp? -59.06 -41.41 87.85 Favored 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 111.889 0.329 . . . . 0.0 111.889 -178.579 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 37.6 m -60.49 -44.33 96.06 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 123.011 0.524 . . . . 0.0 111.117 177.559 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 63.1 mt -63.89 -42.55 96.18 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 C-N-CA 123.892 0.877 . . . . 0.0 110.24 179.109 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 34.3 mmt180 -58.89 -39.58 81.87 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 122.98 0.512 . . . . 0.0 110.65 175.608 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 65.9 m-20 -67.02 -53.66 29.17 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 122.738 0.415 . . . . 0.0 111.286 178.548 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 . . . . . 0 C--O 1.251 1.177 0 CA-C-O 117.517 -1.23 . . . . 0.0 110.487 -173.41 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.736 0 N-CA-C 111.734 0.272 . . . . 0.0 111.734 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 7.6 p -76.13 82.47 0.67 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.339 0 C-N-CA 123.692 0.797 . . . . 0.0 109.842 179.019 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -55.74 -41.34 73.77 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 124.155 0.982 . . . . 0.0 111.297 178.094 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 40.0 mt-30 -78.1 72.92 4.66 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 123.833 0.853 . . . . 0.0 110.17 177.945 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 86.1 p -147.0 -118.18 0.07 Allowed 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 124.044 0.937 . . . . 0.0 109.07 173.761 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 56.7 t80 -80.53 64.24 5.25 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 124.329 1.052 . . . . 0.0 109.664 -178.521 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 30.8 m120 -153.05 -65.26 0.15 Allowed 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 126.359 1.864 . . . . 0.0 106.874 -176.084 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 26.3 ptt? -58.95 -37.14 76.07 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 123.349 0.66 . . . . 0.0 110.321 172.428 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 40.3 mt-30 -54.36 -51.61 64.23 Favored 'General case' 0 C--N 1.341 0.235 0 C-N-CA 123.885 0.874 . . . . 0.0 110.064 171.401 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.3 tp-100 -58.64 -45.04 90.14 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 123.543 0.737 . . . . 0.0 110.905 -179.349 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 29.1 mm100 -60.86 -36.09 78.28 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-O 118.995 -0.526 . . . . 0.0 111.463 175.519 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.81 -39.46 83.98 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 118.473 0.579 . . . . 0.0 111.251 176.115 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 74.5 mtt85 -61.18 -46.71 89.38 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 118.42 0.554 . . . . 0.0 110.308 175.449 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 21.7 m-85 -61.14 -46.76 89.22 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 122.659 0.384 . . . . 0.0 111.261 175.855 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 52.8 t80 -54.81 -49.92 69.81 Favored 'General case' 0 C--O 1.225 -0.208 0 C-N-CA 124.034 0.933 . . . . 0.0 110.32 179.741 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -57.59 -52.81 63.9 Favored 'General case' 0 CA--C 1.531 0.229 0 N-CA-C 109.712 -0.477 . . . . 0.0 109.712 174.704 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -70.27 9.67 0.56 Allowed 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.885 1.274 . . . . 0.0 114.12 -179.987 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 64.6 tp -123.25 -37.48 2.69 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.457 1.103 . . . . 0.0 110.971 172.672 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 17.2 m-70 -90.95 -28.68 17.9 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.871 1.268 . . . . 0.0 113.464 -174.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -51.07 136.67 28.22 Favored Pre-proline 0 CA--C 1.543 0.687 0 C-N-CA 124.264 1.026 . . . . 0.0 112.297 -174.661 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_exo -45.53 -46.52 14.52 Favored 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 124.541 3.494 . . . . 0.0 115.777 -179.807 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 3.6 t30 -67.38 120.53 14.02 Favored 'General case' 0 C--N 1.34 0.172 0 N-CA-C 109.678 -0.49 . . . . 0.0 109.678 -177.699 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -156.04 130.28 8.76 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 122.86 0.464 . . . . 0.0 111.083 -173.911 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 1.8 p-10 -157.58 33.67 0.27 Allowed 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.11 0.964 . . . . 0.0 111.142 170.043 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.8 tm-20 72.33 -57.39 0.62 Allowed 'General case' 0 C--N 1.346 0.427 0 C-N-CA 127.054 2.142 . . . . 0.0 113.499 174.668 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 6.6 tm-20 -54.64 -49.53 70.34 Favored 'General case' 0 CA--C 1.529 0.158 0 C-N-CA 124.649 1.18 . . . . 0.0 110.416 -177.081 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 13.4 mm100 -56.27 -49.88 72.94 Favored 'General case' 0 C--N 1.341 0.233 0 C-N-CA 123.259 0.623 . . . . 0.0 109.764 -178.231 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 5.3 mpt_? -51.44 -73.82 0.04 OUTLIER 'General case' 0 CA--C 1.515 -0.385 0 C-N-CA 125.12 1.368 . . . . 0.0 110.745 178.023 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 18.3 m-80 -54.24 -38.15 65.42 Favored 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 111.914 0.339 . . . . 0.0 111.914 -170.787 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -61.16 -58.14 9.58 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 123.071 0.549 . . . . 0.0 111.812 175.933 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 14.8 ptpt -67.83 -44.23 77.72 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 118.008 0.367 . . . . 0.0 111.132 -174.679 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 6.3 mm -48.05 -52.04 8.01 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.16 0 C-N-CA 125.686 1.595 . . . . 0.0 109.962 174.148 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 23.0 ttmm -60.91 -48.95 79.44 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 123.804 0.842 . . . . 0.0 111.248 -178.763 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 83.7 p -62.79 -40.88 98.69 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 122.553 0.341 . . . . 0.0 111.849 -178.176 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 61.3 mt -63.3 -44.13 98.98 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.321 0 C-N-CA 124.075 0.95 . . . . 0.0 109.057 175.021 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 33.2 ttm180 -80.88 55.01 2.31 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 125.176 1.391 . . . . 0.0 110.478 179.447 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -109.23 -51.35 2.89 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 125.58 1.552 . . . . 0.0 108.666 175.341 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 29.8 t70 . . . . . 0 C--O 1.25 1.106 0 CA-C-O 117.365 -1.303 . . . . 0.0 108.063 176.952 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 0.65 0 CA-C-O 119.17 -0.443 . . . . 0.0 110.851 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 14.6 m 40.83 -116.7 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 C-N-CA 126.105 1.762 . . . . 0.0 112.572 177.608 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -57.78 -33.13 68.2 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 125.03 1.332 . . . . 0.0 113.539 -179.385 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 6.6 tm0? 70.38 -69.06 0.18 Allowed 'General case' 0 C--N 1.342 0.255 0 C-N-CA 126.531 1.932 . . . . 0.0 110.875 -175.891 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 7.8 m -66.41 -7.04 16.72 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 124.882 1.273 . . . . 0.0 114.211 -169.997 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 36.3 p90 -146.19 30.96 1.02 Allowed 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 124.2 1.0 . . . . 0.0 110.845 169.937 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -132.92 -68.48 0.59 Allowed 'General case' 0 C--N 1.338 0.102 0 C-N-CA 125.16 1.384 . . . . 0.0 108.926 175.059 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 96.1 mmm -68.37 -33.98 75.25 Favored 'General case' 0 N--CA 1.456 -0.142 0 C-N-CA 123.623 0.769 . . . . 0.0 110.099 176.339 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 21.3 tt0 -54.49 -62.46 1.64 Allowed 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 169.92 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 72.7 mt-30 -60.64 -35.06 75.25 Favored 'General case' 0 C--N 1.34 0.153 0 C-N-CA 124.101 0.96 . . . . 0.0 111.97 -175.1 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -52.72 -48.97 66.3 Favored 'General case' 0 N--CA 1.456 -0.17 0 C-N-CA 123.058 0.543 . . . . 0.0 109.666 171.582 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 16.2 mmm-85 -67.91 -34.28 76.32 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-O 118.47 -0.776 . . . . 0.0 112.88 175.907 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 28.4 mmt85 -56.58 -51.7 67.64 Favored 'General case' 0 C--N 1.341 0.236 0 CA-C-N 119.175 0.898 . . . . 0.0 109.705 175.166 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 11.0 m-85 -56.47 -52.19 65.62 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 123.814 0.845 . . . . 0.0 110.918 173.419 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 31.6 t80 -78.97 60.91 3.03 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.485 1.114 . . . . 0.0 109.883 -179.529 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 178.94 -55.03 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 127.339 2.256 . . . . 0.0 107.362 -174.724 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.37 -44.99 96.23 Favored 'General case' 0 C--N 1.34 0.181 0 C-N-CA 124.899 1.279 . . . . 0.0 110.565 175.232 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 89.4 mt -58.33 -47.43 83.76 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 123.118 0.567 . . . . 0.0 109.844 172.343 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 22.5 m-70 -86.37 54.96 3.34 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 124.412 1.085 . . . . 0.0 110.331 -176.535 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 10.6 t0 -124.99 85.18 58.14 Favored Pre-proline 0 CA--C 1.535 0.373 0 C-N-CA 124.425 1.09 . . . . 0.0 109.382 -175.93 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -82.14 59.4 7.02 Favored 'Trans proline' 0 N--CA 1.456 -0.71 0 C-N-CA 123.856 3.037 . . . . 0.0 109.887 179.626 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -155.72 -58.62 0.1 Allowed 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 124.586 1.154 . . . . 0.0 108.981 179.286 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 91.2 mt -70.78 144.16 50.96 Favored 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 174.699 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 29.8 p-10 -79.51 174.66 11.35 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-O 121.195 0.521 . . . . 0.0 110.867 179.943 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 35.8 tp10 -60.88 -36.75 80.02 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 123.772 0.829 . . . . 0.0 111.592 -176.995 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 51.9 mt-10 -59.76 -57.51 12.59 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 123.322 0.649 . . . . 0.0 110.735 179.728 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 37.3 mt-30 -59.59 -47.76 84.31 Favored 'General case' 0 CA--C 1.529 0.148 0 C-N-CA 124.042 0.937 . . . . 0.0 110.787 -178.995 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 12.1 ttp-105 -52.83 -55.13 25.28 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 124.716 1.206 . . . . 0.0 111.046 176.972 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 6.5 m120 -59.95 -44.91 94.11 Favored 'General case' 0 CA--C 1.529 0.156 0 C-N-CA 122.693 0.397 . . . . 0.0 110.858 179.324 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.19 -51.08 69.34 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 123.991 0.916 . . . . 0.0 111.744 -177.768 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 19.7 ptpt -65.09 -41.41 95.02 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 118.113 0.415 . . . . 0.0 111.302 179.499 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 5.7 mt -60.39 -52.27 63.33 Favored 'Isoleucine or valine' 0 C--N 1.34 0.171 0 CA-C-O 118.755 -0.64 . . . . 0.0 111.176 -179.452 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 15.0 ptmm? -62.09 -37.67 85.95 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 118.856 0.753 . . . . 0.0 111.591 -178.783 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 55.7 m -61.24 -50.51 72.76 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 122.9 0.48 . . . . 0.0 111.014 177.531 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 89.3 mt -60.88 -51.71 70.02 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 C-N-CA 123.89 0.876 . . . . 0.0 110.195 179.194 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 37.7 ttm180 -60.24 -36.29 77.42 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 124.846 1.258 . . . . 0.0 111.624 -177.172 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -74.45 80.68 1.92 Allowed 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 123.729 0.812 . . . . 0.0 109.293 173.391 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 . . . . . 0 C--O 1.251 1.144 0 C-N-CA 126.591 1.957 . . . . 0.0 110.658 178.27 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.74 0 N-CA-C 111.639 0.237 . . . . 0.0 111.639 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 87.3 t -70.11 109.16 2.54 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.205 0 N-CA-C 108.979 -0.749 . . . . 0.0 108.979 179.937 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -79.44 -88.02 0.06 Allowed 'General case' 0 CA--C 1.531 0.238 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 176.789 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 65.6 mm-40 47.19 57.61 5.6 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 125.497 1.519 . . . . 0.0 111.606 177.906 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 18.2 t -91.16 -147.95 0.21 Allowed 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.711 1.204 . . . . 0.0 109.195 -177.486 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 4.1 t80 -68.84 96.54 0.76 Allowed 'General case' 0 N--CA 1.446 -0.652 0 N-CA-C 106.843 -1.54 . . . . 0.0 106.843 170.715 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 51.2 t30 -38.39 -54.4 1.46 Allowed 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 125.999 1.719 . . . . 0.0 112.66 -179.716 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 13.5 tpt -81.9 64.49 6.62 Favored 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 123.421 0.688 . . . . 0.0 109.963 178.577 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 3.4 tm0? 176.42 -48.21 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 128.273 2.629 . . . . 0.0 106.786 -177.586 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 63.6 tt0 -57.27 -49.51 75.85 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 125.242 1.417 . . . . 0.0 109.468 172.619 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -57.75 -38.06 74.73 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.868 1.267 . . . . 0.0 111.617 174.487 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 40.6 tpt85 -67.65 -51.81 45.55 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 123.715 0.806 . . . . 0.0 110.631 -178.768 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 78.2 ttt-85 -57.74 -51.71 68.44 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 125.586 1.554 . . . . 0.0 110.645 176.793 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 13.1 t80 -47.14 -59.74 2.94 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 126.243 1.817 . . . . 0.0 111.513 173.508 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 50.9 t80 -56.09 -49.18 74.56 Favored 'General case' 0 N--CA 1.456 -0.141 0 C-N-CA 124.128 0.971 . . . . 0.0 110.843 -179.42 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -56.77 -54.52 45.31 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 123.442 0.697 . . . . 0.0 110.748 -177.822 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.21 -44.52 97.15 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 123.658 0.783 . . . . 0.0 111.944 -178.349 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 59.8 tp -61.36 -53.2 59.75 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 124.23 1.012 . . . . 0.0 110.993 -179.621 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 19.4 m-70 -76.62 -50.98 12.46 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 123.593 0.757 . . . . 0.0 111.951 -173.694 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 9.5 t0 -67.23 124.29 88.6 Favored Pre-proline 0 CA--C 1.535 0.389 0 CA-C-O 118.87 -0.586 . . . . 0.0 109.668 -174.84 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_endo -76.15 -10.03 19.3 Favored 'Trans proline' 0 N--CA 1.456 -0.707 0 C-N-CA 123.412 2.741 . . . . 0.0 114.355 -171.937 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -62.56 -31.84 72.7 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 114.382 1.253 . . . . 0.0 114.382 -169.981 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 10.6 mp -63.67 146.63 53.44 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 118.555 0.616 . . . . 0.0 110.073 177.153 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 44.0 p-10 -84.62 29.35 0.61 Allowed 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 114.451 1.278 . . . . 0.0 114.451 -169.71 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 76.34 -58.37 0.53 Allowed 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 124.852 1.261 . . . . 0.0 111.384 -174.878 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 5.6 mp0 -56.88 -49.95 73.98 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 123.385 0.674 . . . . 0.0 110.663 -178.732 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 59.7 mt-30 -51.61 -60.0 3.65 Favored 'General case' 0 C--N 1.34 0.17 0 C-N-CA 124.44 1.096 . . . . 0.0 111.084 178.423 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 10.7 ptp85 -63.42 -44.97 93.08 Favored 'General case' 0 C--N 1.342 0.251 0 CA-C-O 119.253 -0.403 . . . . 0.0 110.75 -175.883 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -55.23 -51.86 65.23 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 123.748 0.819 . . . . 0.0 111.094 -178.132 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -53.78 -53.52 51.15 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 123.641 0.777 . . . . 0.0 111.485 -178.475 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 19.9 ptpt -69.8 -36.94 76.08 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-O 118.648 -0.691 . . . . 0.0 112.007 -178.704 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 44.4 mt -59.44 -45.3 93.73 Favored 'Isoleucine or valine' 0 C--N 1.34 0.189 0 CA-C-N 119.1 0.864 . . . . 0.0 110.162 178.855 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 44.2 mmtm -59.29 -43.27 92.57 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 122.49 0.316 . . . . 0.0 110.496 175.639 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 16.0 m -63.75 -42.21 97.89 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.281 0.632 . . . . 0.0 111.714 179.104 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 30.5 mt -61.56 -49.41 84.51 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.195 0 C-N-CA 125.128 1.371 . . . . 0.0 109.228 176.884 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -82.87 51.47 1.92 Allowed 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 124.714 1.206 . . . . 0.0 110.57 -179.679 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 3.9 p30 -81.99 -36.19 28.14 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 123.299 0.64 . . . . 0.0 109.792 171.431 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 10.0 p-10 . . . . . 0 C--O 1.252 1.191 0 C-N-CA 124.908 1.283 . . . . 0.0 110.459 176.632 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.75 0 CA-C-O 120.706 0.288 . . . . 0.0 111.189 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 24.7 t -80.37 76.03 0.85 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 -179.388 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -64.52 -41.57 96.3 Favored 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 123.926 0.89 . . . . 0.0 110.838 178.527 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 7.0 pt20 -139.05 178.25 7.3 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 124.91 1.284 . . . . 0.0 109.489 177.095 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 53.0 m -76.4 102.38 5.94 Favored 'General case' 0 N--CA 1.448 -0.555 0 N-CA-C 106.133 -1.802 . . . . 0.0 106.133 169.681 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 62.2 m-85 -79.24 66.61 4.74 Favored 'General case' 0 N--CA 1.457 -0.115 0 CA-C-O 121.721 0.772 . . . . 0.0 109.645 179.498 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 29.6 m-80 -136.14 -49.39 0.68 Allowed 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 126.505 1.922 . . . . 0.0 108.019 -177.936 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 25.4 ptt? -63.9 -40.62 96.93 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 122.826 0.45 . . . . 0.0 110.498 171.05 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 31.5 tt0 -61.22 -48.18 82.69 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 123.086 0.555 . . . . 0.0 110.05 175.205 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 21.4 tt0 -55.47 -51.69 66.11 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 123.826 0.85 . . . . 0.0 110.221 177.705 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 20.1 tt0 -53.81 -37.02 63.11 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 125.286 1.434 . . . . 0.0 111.508 176.47 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 13.4 mmp_? -70.78 -51.29 27.92 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 118.883 0.765 . . . . 0.0 111.64 178.832 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.42 -50.38 67.73 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 118.897 0.772 . . . . 0.0 109.996 176.973 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 78.1 t80 -50.32 -55.88 13.63 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 126.941 2.096 . . . . 0.0 112.081 174.172 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 49.4 t80 -58.82 -48.66 80.52 Favored 'General case' 0 C--N 1.339 0.14 0 C-N-CA 124.6 1.16 . . . . 0.0 110.927 -178.298 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -54.91 -54.67 39.64 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 123.494 0.717 . . . . 0.0 109.806 178.985 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -56.68 -49.08 76.16 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 122.616 0.366 . . . . 0.0 111.904 -179.671 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 54.4 tp -58.43 -53.67 55.68 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 124.084 0.954 . . . . 0.0 111.333 -178.837 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 19.4 m-70 -77.39 -45.77 24.86 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.783 0.833 . . . . 0.0 112.648 -171.489 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 80.0 m-20 -62.9 130.7 94.19 Favored Pre-proline 0 CA--C 1.537 0.456 0 CA-C-N 118.215 0.462 . . . . 0.0 110.647 -171.254 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -70.77 -29.28 19.3 Favored 'Trans proline' 0 N--CA 1.457 -0.634 0 C-N-CA 123.973 3.115 . . . . 0.0 113.562 -169.755 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 9.8 p-10 -58.76 -27.99 65.48 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 118.493 0.588 . . . . 0.0 111.796 -179.863 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -84.08 72.13 10.5 Favored 'General case' 0 C--N 1.342 0.273 0 N-CA-C 106.112 -1.81 . . . . 0.0 106.112 169.442 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 -77.29 58.09 1.58 Allowed 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 125.612 1.565 . . . . 0.0 112.687 -169.997 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 22.6 tt0 70.76 157.59 0.17 Allowed 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 125.239 1.416 . . . . 0.0 110.63 -176.919 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.3 tp10 73.8 -56.13 0.65 Allowed 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 127.027 2.131 . . . . 0.0 110.811 -175.392 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 50.9 mt-30 -54.86 -61.59 2.21 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 125.31 1.444 . . . . 0.0 110.01 175.632 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 19.4 ptt180 -63.23 -38.88 92.92 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 123.599 0.76 . . . . 0.0 111.76 178.861 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 14.4 m120 -61.0 -45.02 96.5 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 118.387 0.539 . . . . 0.0 111.099 179.924 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -60.12 -47.54 85.48 Favored 'General case' 0 CA--C 1.529 0.165 0 C-N-CA 123.564 0.745 . . . . 0.0 110.439 176.639 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 30.6 tttt -55.32 -51.17 67.59 Favored 'General case' 0 N--CA 1.448 -0.541 0 C-N-CA 123.441 0.697 . . . . 0.0 111.396 175.748 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 58.2 mt -58.39 -44.73 89.2 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.205 0 C-N-CA 124.269 1.028 . . . . 0.0 110.293 -179.361 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 27.2 ttpp -58.77 -46.95 86.32 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 123.488 0.715 . . . . 0.0 111.251 177.071 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 88.9 p -68.22 -37.87 81.3 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 118.438 0.563 . . . . 0.0 111.94 -179.705 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 68.8 mt -64.82 -60.7 2.34 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.188 0 C-N-CA 123.907 0.883 . . . . 0.0 110.149 179.238 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 17.7 ptp180 -133.66 70.38 1.46 Allowed 'General case' 0 N--CA 1.456 -0.133 0 C-N-CA 123.99 0.916 . . . . 0.0 109.734 -173.215 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -53.26 -48.83 67.94 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 124.363 1.065 . . . . 0.0 111.556 177.968 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 38.2 t70 . . . . . 0 C--O 1.25 1.092 0 CA-C-O 116.536 -1.697 . . . . 0.0 110.724 179.125 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.733 0 N-CA-C 111.484 0.179 . . . . 0.0 111.484 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 34.4 m -61.07 -22.65 27.64 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.23 0 C-N-CA 123.904 0.882 . . . . 0.0 112.967 -179.532 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -55.4 -46.44 76.59 Favored 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 124.655 1.182 . . . . 0.0 110.574 174.141 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 8.8 tp-100 -68.89 97.56 0.85 Allowed 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 175.022 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 42.5 m -102.03 57.41 0.81 Allowed 'General case' 0 N--CA 1.448 -0.557 0 C-N-CA 125.515 1.526 . . . . 0.0 107.595 -175.766 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 44.1 p90 -53.31 -25.39 14.69 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 124.777 1.231 . . . . 0.0 111.365 177.026 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 5.3 p-10 -53.63 -32.1 49.96 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 124.354 1.062 . . . . 0.0 112.29 178.286 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 95.0 mmm -63.65 -51.56 64.59 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 123.258 0.623 . . . . 0.0 110.936 -179.807 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -67.22 -38.46 85.28 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-O 119.236 -0.412 . . . . 0.0 110.649 176.105 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -82.93 51.1 1.85 Allowed 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.227 1.411 . . . . 0.0 109.969 176.272 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? -165.17 -52.78 0.03 OUTLIER 'General case' 0 CA--C 1.523 -0.075 0 C-N-CA 126.777 2.031 . . . . 0.0 106.465 -178.947 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 6.1 tmm_? -50.78 -48.56 59.35 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 125.435 1.494 . . . . 0.0 109.874 171.961 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 19.2 ptp180 -63.87 -45.24 90.34 Favored 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 112.582 0.586 . . . . 0.0 112.582 -179.01 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 60.8 m-85 -64.11 -47.42 80.07 Favored 'General case' 0 C--N 1.339 0.139 0 C-N-CA 122.66 0.384 . . . . 0.0 110.386 -179.66 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 64.1 t80 -56.64 -46.82 80.77 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 123.902 0.881 . . . . 0.0 110.495 175.236 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 12.9 tp10 -58.77 -58.47 8.46 Favored 'General case' 0 N--CA 1.455 -0.225 0 C-N-CA 122.949 0.5 . . . . 0.0 110.027 -179.228 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -52.93 -47.24 68.17 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 124.648 1.179 . . . . 0.0 111.588 -179.982 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 63.7 tp -60.14 -49.93 75.69 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.095 0.958 . . . . 0.0 110.612 178.221 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 17.1 m-70 -85.46 54.76 3.23 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.135 0.974 . . . . 0.0 110.453 -178.996 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 73.7 m-20 -135.29 83.49 38.16 Favored Pre-proline 0 CA--C 1.532 0.288 0 C-N-CA 124.698 1.199 . . . . 0.0 108.68 171.482 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_exo -51.99 -42.93 55.72 Favored 'Trans proline' 0 N--CA 1.459 -0.517 0 C-N-CA 124.118 3.212 . . . . 0.0 113.167 175.721 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 50.3 t30 -55.29 -46.66 76.2 Favored 'General case' 0 C--N 1.341 0.21 0 C-N-CA 124.6 1.16 . . . . 0.0 111.651 -178.611 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -73.04 108.81 6.14 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 106.734 -1.58 . . . . 0.0 106.734 173.346 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 1.9 p30 -64.79 170.14 4.47 Favored 'General case' 0 CA--C 1.531 0.218 0 N-CA-C 111.538 0.199 . . . . 0.0 111.538 -172.389 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -47.05 -41.73 17.27 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 124.659 1.184 . . . . 0.0 112.683 -177.093 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 14.3 tp10 -60.83 -58.47 8.31 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 118.354 0.525 . . . . 0.0 110.976 179.503 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 71.9 mt-30 -58.15 -50.55 73.11 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 124.211 1.004 . . . . 0.0 110.806 -178.507 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 17.9 ttp180 -56.83 -55.17 37.83 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 125.594 1.558 . . . . 0.0 110.999 -179.813 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 -60.04 -42.2 93.92 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 122.806 0.443 . . . . 0.0 111.109 179.474 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.96 -43.34 91.27 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 123.196 0.599 . . . . 0.0 111.167 177.509 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 25.8 mmtp -58.5 -58.46 8.42 Favored 'General case' 0 C--N 1.341 0.229 0 C-N-CA 122.875 0.47 . . . . 0.0 110.181 174.883 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 30.3 mm -48.87 -51.77 11.32 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 C-N-CA 123.623 0.769 . . . . 0.0 110.724 -179.522 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 66.0 tttp -61.41 -54.85 38.21 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 124.303 1.041 . . . . 0.0 111.221 -178.168 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 85.6 p -59.3 -38.67 80.81 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 123.261 0.625 . . . . 0.0 112.141 -175.593 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 71.6 mt -61.04 -55.07 27.19 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 C-N-CA 123.578 0.751 . . . . 0.0 110.442 -179.502 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 19.5 ptp180 -72.05 -49.51 36.08 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 118.155 0.434 . . . . 0.0 111.447 -178.225 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -92.87 67.75 4.43 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 124.697 1.199 . . . . 0.0 108.631 177.979 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 8.8 p-10 . . . . . 0 C--O 1.251 1.142 0 CA-C-O 116.857 -1.544 . . . . 0.0 110.394 178.033 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 0.649 0 CA-C-O 120.082 -0.009 . . . . 0.0 110.993 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 19.6 m -147.2 149.38 15.68 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.235 0 C-N-CA 125.084 1.354 . . . . 0.0 109.025 176.482 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -158.68 79.48 0.79 Allowed 'General case' 0 N--CA 1.456 -0.142 0 N-CA-C 107.982 -1.118 . . . . 0.0 107.982 176.261 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 5.6 pt20 -147.79 52.23 1.04 Allowed 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 124.326 1.05 . . . . 0.0 109.757 -174.102 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 67.1 m -82.71 -96.63 0.05 Allowed 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 124.102 0.961 . . . . 0.0 109.96 -179.008 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -84.94 69.04 10.74 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 124.386 1.074 . . . . 0.0 108.205 177.703 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 53.0 m-80 -49.0 -50.18 37.13 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 125.59 1.556 . . . . 0.0 113.282 -170.309 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 25.2 ptp -63.83 -29.61 70.79 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 112.861 0.689 . . . . 0.0 112.861 -177.317 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 42.5 tt0 -79.6 -44.01 21.83 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 123.388 0.675 . . . . 0.0 109.788 176.615 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 20.3 tt0 -56.6 -41.58 77.26 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.532 1.133 . . . . 0.0 110.775 176.795 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 18.4 tt0 -54.4 -29.76 50.03 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 126.204 1.801 . . . . 0.0 112.021 175.042 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 21.0 mmt85 -70.71 -57.54 4.57 Favored 'General case' 0 C--N 1.341 0.2 0 CA-C-N 118.972 0.806 . . . . 0.0 109.397 177.668 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 79.7 mtt85 -50.58 -47.67 57.86 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 124.215 1.006 . . . . 0.0 110.632 177.76 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 31.2 t80 -48.68 -51.35 28.97 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 126.423 1.889 . . . . 0.0 111.287 173.891 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 18.2 m-30 -68.0 -35.67 78.72 Favored 'General case' 0 C--O 1.225 -0.218 0 C-N-CA 123.233 0.613 . . . . 0.0 111.649 179.142 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -60.55 -25.23 66.0 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 119.803 1.183 . . . . 0.0 111.64 175.813 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -84.45 -49.79 8.34 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 123.234 0.614 . . . . 0.0 111.497 171.727 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 34.4 tp -82.42 -57.47 3.34 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.065 0.946 . . . . 0.0 111.413 -170.295 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 25.0 m170 -77.68 69.63 3.95 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 125.404 1.482 . . . . 0.0 108.778 177.727 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -158.45 158.38 29.56 Favored Pre-proline 0 CA--C 1.534 0.333 0 C-N-CA 124.666 1.186 . . . . 0.0 107.866 -172.157 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -67.5 42.2 0.21 Allowed 'Trans proline' 0 CA--C 1.544 1.01 0 C-N-CA 123.737 2.958 . . . . 0.0 114.219 169.767 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 14.9 t-20 61.16 92.89 0.05 OUTLIER 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 126.955 2.102 . . . . 0.0 112.578 177.777 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 78.2 mt -64.51 162.32 15.59 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 169.729 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 10.0 p30 -54.63 144.41 21.87 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 123.088 0.555 . . . . 0.0 110.646 178.182 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 15.3 mp0 -52.45 -42.18 63.94 Favored 'General case' 0 C--O 1.226 -0.143 0 C-N-CA 124.411 1.084 . . . . 0.0 112.013 -173.932 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.4 tm-20 -56.43 -61.73 2.21 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 122.915 0.486 . . . . 0.0 110.551 -177.757 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 26.9 mm100 -61.2 -51.95 66.86 Favored 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 123.135 0.574 . . . . 0.0 110.916 179.197 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 32.2 ttp-105 -57.19 -61.98 2.08 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 123.693 0.797 . . . . 0.0 110.706 -174.142 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 14.4 t-20 -59.39 -39.7 84.19 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 123.974 0.91 . . . . 0.0 111.174 -175.548 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -57.15 -51.27 70.0 Favored 'General case' 0 C--N 1.342 0.257 0 C-N-CA 122.695 0.398 . . . . 0.0 110.83 176.447 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 59.8 mtpt -59.3 -54.84 42.16 Favored 'General case' 0 C--N 1.341 0.238 0 C-N-CA 123.081 0.552 . . . . 0.0 110.59 177.381 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 14.6 mm -51.14 -49.73 28.0 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.276 0 C-N-CA 124.207 1.003 . . . . 0.0 110.682 -178.384 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 27.7 tptp -73.07 -42.21 63.3 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 123.216 0.606 . . . . 0.0 111.973 -175.445 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 99.1 p -61.97 -34.39 76.05 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 118.647 0.658 . . . . 0.0 111.015 178.873 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 90.7 mt -73.11 -49.47 38.28 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.255 0 C-N-CA 124.518 1.127 . . . . 0.0 109.596 175.682 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 81.5 mtp180 -89.77 61.78 5.52 Favored 'General case' 0 CA--C 1.529 0.165 0 C-N-CA 124.228 1.011 . . . . 0.0 108.822 176.542 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 30.2 t0 -77.75 83.32 4.11 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 123.817 0.847 . . . . 0.0 109.387 -176.318 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 33.3 t70 . . . . . 0 C--O 1.25 1.106 0 C-N-CA 125.398 1.479 . . . . 0.0 108.698 175.509 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 0.72 0 N-CA-C 111.651 0.241 . . . . 0.0 111.651 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 16.4 t 59.13 76.27 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.28 0 C-N-CA 125.251 1.42 . . . . 0.0 110.002 -179.561 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -64.72 130.14 42.43 Favored 'General case' 0 N--CA 1.456 -0.169 0 N-CA-C 109.496 -0.557 . . . . 0.0 109.496 176.868 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 29.3 mm100 -81.81 40.8 0.62 Allowed 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 124.093 0.957 . . . . 0.0 111.715 -175.333 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 21.5 m -59.55 -34.24 72.42 Favored 'General case' 0 N--CA 1.456 -0.171 0 C-N-CA 124.185 0.994 . . . . 0.0 111.531 177.806 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 48.3 p90 -74.6 28.68 0.08 Allowed 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.733 1.613 . . . . 0.0 113.386 -178.816 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 13.2 m-80 -144.43 -53.89 0.33 Allowed 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 125.178 1.391 . . . . 0.0 109.416 -177.783 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -102.03 -33.83 9.57 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 123.938 0.895 . . . . 0.0 113.222 -173.638 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 27.6 mm100 -76.12 -57.3 3.95 Favored 'General case' 0 C--N 1.343 0.296 0 CA-C-N 119.712 1.142 . . . . 0.0 107.946 169.858 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 20.2 mt-30 -82.47 106.34 14.25 Favored 'General case' 0 N--CA 1.449 -0.504 0 N-CA-C 107.394 -1.336 . . . . 0.0 107.394 178.476 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 17.8 tp60 -149.51 -51.21 0.15 Allowed 'General case' 0 CA--C 1.532 0.25 0 CA-C-O 118.923 -0.561 . . . . 0.0 111.834 -176.663 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -70.11 -79.59 0.06 Allowed 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 118.851 0.751 . . . . 0.0 110.557 -172.874 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -55.88 -26.2 46.01 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 124.522 1.129 . . . . 0.0 112.243 173.688 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 62.2 t80 -67.75 -49.43 62.57 Favored 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 125.202 1.401 . . . . 0.0 110.973 178.94 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 70.4 t80 -58.08 -41.15 82.82 Favored 'General case' 0 C--N 1.34 0.19 0 CA-C-O 119.194 -0.431 . . . . 0.0 110.128 174.31 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 15.3 tp10 -59.23 -57.97 10.67 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 118.356 0.525 . . . . 0.0 110.042 176.68 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -52.68 -46.46 67.27 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 124.672 1.189 . . . . 0.0 112.359 -178.245 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 73.0 mt -62.75 -62.14 1.93 Allowed 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.211 0.604 . . . . 0.0 109.775 175.776 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 19.6 m-70 -84.97 48.82 1.62 Allowed 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.53 1.132 . . . . 0.0 110.711 -177.095 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -77.73 162.13 69.16 Favored Pre-proline 0 CA--C 1.538 0.488 0 N-CA-C 108.394 -0.965 . . . . 0.0 108.394 173.711 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -79.13 65.2 8.88 Favored 'Trans proline' 0 N--CA 1.454 -0.842 0 C-N-CA 124.243 3.295 . . . . 0.0 109.861 179.704 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 31.0 m120 59.25 67.78 0.87 Allowed 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 126.792 2.037 . . . . 0.0 112.768 169.97 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 82.0 mt -67.92 166.42 15.71 Favored 'General case' 0 CA--C 1.532 0.283 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 169.72 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 48.7 p-10 -75.9 26.35 0.11 Allowed 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.851 1.26 . . . . 0.0 113.91 -174.54 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 73.01 -55.61 0.68 Allowed 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 126.03 1.732 . . . . 0.0 111.689 -174.954 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -53.83 -54.53 37.12 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 125.094 1.358 . . . . 0.0 111.303 -177.567 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 42.7 mt-30 -61.22 -45.31 95.09 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 123.686 0.794 . . . . 0.0 111.128 -178.813 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 37.6 ttm105 -56.98 -55.85 29.32 Favored 'General case' 0 C--N 1.34 0.196 0 C-N-CA 122.845 0.458 . . . . 0.0 110.118 177.394 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 47.9 m-20 -54.35 -45.19 72.68 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 123.994 0.918 . . . . 0.0 111.052 -179.865 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.43 -43.97 88.94 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 123.351 0.66 . . . . 0.0 111.302 177.165 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 61.2 mtpt -62.06 -45.15 94.79 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-O 119.079 -0.486 . . . . 0.0 110.91 176.986 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 45.2 mm -57.98 -47.34 86.85 Favored 'Isoleucine or valine' 0 C--N 1.342 0.259 0 CA-C-N 118.851 0.751 . . . . 0.0 110.328 176.183 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 63.0 mttp -58.75 -39.16 80.13 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 123.035 0.534 . . . . 0.0 111.563 177.52 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 40.4 m -63.72 -46.42 85.5 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 122.853 0.461 . . . . 0.0 110.946 177.189 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 74.1 mt -63.14 -42.16 95.52 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 C-N-CA 123.567 0.747 . . . . 0.0 110.2 178.892 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 1.5 mmp_? -59.33 -52.24 66.49 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 124.043 0.937 . . . . 0.0 110.035 176.611 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -82.97 70.54 9.99 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 124.361 1.064 . . . . 0.0 109.595 179.535 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 32.9 t70 . . . . . 0 C--O 1.252 1.197 0 CA-C-O 117.184 -1.388 . . . . 0.0 109.257 -179.671 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 0.684 0 CA-C-O 120.771 0.32 . . . . 0.0 111.154 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 41.0 t -79.02 82.21 1.02 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.238 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 -179.751 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -78.95 69.8 5.17 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 124.212 1.005 . . . . 0.0 109.929 179.187 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 10.2 tt0 -68.18 136.61 53.89 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 123.607 0.763 . . . . 0.0 109.897 179.79 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 30.7 p -76.82 -70.0 0.49 Allowed 'General case' 0 N--CA 1.454 -0.244 0 CA-C-O 121.695 0.76 . . . . 0.0 109.092 171.954 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 5.3 p90 -163.16 20.67 0.08 Allowed 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 127.318 2.247 . . . . 0.0 110.366 179.906 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 19.3 m120 -59.65 -40.91 89.24 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 125.459 1.504 . . . . 0.0 112.755 -169.755 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 25.7 ttt -64.44 -41.76 96.38 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 123.063 0.545 . . . . 0.0 110.226 176.643 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 86.2 mm-40 -89.98 44.89 1.23 Allowed 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 124.124 0.97 . . . . 0.0 109.929 178.784 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 18.7 tp60 -158.43 -46.23 0.06 Allowed 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 123.782 0.833 . . . . 0.0 110.701 -175.363 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 22.6 pt20 -50.48 -35.93 31.35 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.394 1.077 . . . . 0.0 112.653 178.166 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 19.5 tpp85 -71.74 -49.42 39.31 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 124.16 0.984 . . . . 0.0 111.312 -179.522 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 38.6 mtp180 -58.94 -47.49 84.87 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 124.277 1.031 . . . . 0.0 110.078 177.125 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 36.3 t80 -53.25 -55.81 21.55 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 126.694 1.998 . . . . 0.0 110.812 174.577 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 44.7 t80 -54.15 -49.29 69.58 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 123.952 0.901 . . . . 0.0 110.682 177.132 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -56.99 -50.68 71.95 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 123.885 0.874 . . . . 0.0 110.937 -177.404 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.71 -53.03 53.65 Favored 'General case' 0 C--N 1.34 0.17 0 CA-C-O 119.413 -0.327 . . . . 0.0 110.781 178.911 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 9.2 tt -51.13 -45.12 61.52 Favored 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 125.46 1.504 . . . . 0.0 111.175 -178.087 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 15.4 m-70 -75.93 71.51 2.74 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 124.032 0.933 . . . . 0.0 109.562 175.78 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -153.48 141.57 13.9 Favored Pre-proline 0 N--CA 1.453 -0.277 0 C-N-CA 126.464 1.906 . . . . 0.0 106.833 178.191 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_endo -79.77 60.04 7.66 Favored 'Trans proline' 0 N--CA 1.457 -0.655 0 C-N-CA 123.535 2.823 . . . . 0.0 110.359 179.204 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 2.2 t30 66.26 107.09 0.04 OUTLIER 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 127.198 2.199 . . . . 0.0 111.351 177.283 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 75.9 mt -57.12 -65.78 0.56 Allowed 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 123.889 0.876 . . . . 0.0 109.645 178.258 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 43.7 p-10 -159.09 21.39 0.2 Allowed 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 124.199 1.0 . . . . 0.0 111.298 171.912 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 73.8 -52.66 0.69 Allowed 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 126.408 1.883 . . . . 0.0 111.535 -176.986 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -55.4 -68.34 0.2 Allowed 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.944 1.298 . . . . 0.0 110.66 177.958 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 99.9 mm-40 -63.04 -38.56 91.68 Favored 'General case' 0 N--CA 1.457 -0.112 0 C-N-CA 124.2 1.0 . . . . 0.0 110.856 -177.6 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -49.38 -66.3 0.42 Allowed 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 125.044 1.338 . . . . 0.0 110.415 174.239 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 14.4 m-80 -65.43 -38.55 90.24 Favored 'General case' 0 CA--C 1.527 0.082 0 CA-C-O 119.188 -0.434 . . . . 0.0 111.173 -176.668 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -54.36 -47.11 72.97 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 122.931 0.493 . . . . 0.0 111.004 177.78 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 60.1 mttp -59.11 -59.62 5.17 Favored 'General case' 0 C--N 1.342 0.245 0 N-CA-C 109.922 -0.399 . . . . 0.0 109.922 176.602 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 28.4 mm -50.52 -47.07 27.58 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.433 0 C-N-CA 123.794 0.838 . . . . 0.0 111.428 -175.76 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -66.78 -53.4 33.35 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 123.658 0.783 . . . . 0.0 111.607 -179.111 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 89.2 p -60.44 -41.15 93.47 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 123.082 0.553 . . . . 0.0 112.073 -176.738 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 68.0 mt -57.44 -44.42 84.52 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.18 0 C-N-CA 124.759 1.224 . . . . 0.0 110.259 176.073 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 73.6 mtm180 -79.98 57.21 2.57 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 123.273 0.629 . . . . 0.0 110.942 177.255 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 24.9 p-10 -99.36 -52.53 3.48 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 125.009 1.324 . . . . 0.0 109.764 171.094 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 . . . . . 0 C--O 1.251 1.134 0 C-N-CA 125.324 1.449 . . . . 0.0 109.684 177.165 . . . . . . . . 0 0 . 1 stop_ save_