data_1prv_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 1prv _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 ' 4' ' ' ILE . . . . . 0.49 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 0.3 OUTLIER . . . . . 0 CA--C 1.54 0.567 0 N-CA-C 109.94 -0.392 . . . . 0.0 109.94 . . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 34.5 ttmt -55.55 -39.65 70.89 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 122.846 0.458 . . . . 0.0 111.081 -178.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -51.51 -64.93 0.65 Allowed 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 122.898 0.479 . . . . 0.0 111.414 -176.731 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 86.8 t -69.39 -31.81 50.87 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.371 0 N-CA-C 110.646 -0.131 . . . . 0.0 110.646 -177.211 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.04 -41.97 97.58 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 110.267 -0.272 . . . . 0.0 110.267 -179.888 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 31.4 mmtm -81.3 -31.58 33.53 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 122.439 0.296 . . . . 0.0 110.822 -179.168 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 1.3 tpm_? -75.64 -47.52 26.07 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 117.427 0.103 . . . . 0.0 111.047 -177.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -80.68 -49.03 11.74 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 122.163 0.185 . . . . 0.0 111.006 -177.073 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 22.4 m-80 -123.66 -145.41 0.34 Allowed 'General case' 0 C--N 1.341 0.23 0 N-CA-C 109.735 -0.469 . . . . 0.0 109.735 -177.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 58.6 t -102.22 -41.95 8.42 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.249 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 -179.902 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 8.3 t -155.16 176.85 12.02 Favored 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 109.925 -0.398 . . . . 0.0 109.925 -179.752 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 12.6 m -61.47 -21.47 64.2 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.617 -179.284 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 3.7 m -52.18 -49.16 64.38 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 110.179 -0.304 . . . . 0.0 110.179 179.379 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 7.1 m -65.43 -33.32 75.66 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 122.148 0.179 . . . . 0.0 110.722 -179.369 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 58.5 t -68.32 -45.58 82.31 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 -179.79 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 60.4 p -60.42 -35.72 76.47 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-O 119.731 -0.176 . . . . 0.0 110.739 -178.787 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 55.0 m170 -52.61 -37.54 58.45 Favored 'General case' 0 C--N 1.347 0.466 0 CA-C-O 120.568 0.223 . . . . 0.0 110.631 -179.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 60.1 t -72.35 -40.2 64.37 Favored 'Isoleucine or valine' 0 C--O 1.234 0.278 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.493 -178.88 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 76.2 mt -68.84 -56.18 13.04 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.194 0 C-N-CA 122.405 0.282 . . . . 0.0 110.514 -177.854 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 31.1 p30 -76.55 -10.92 59.74 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 119.701 -0.19 . . . . 0.0 111.216 -177.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 39.7 mtmt 56.45 38.7 29.91 Favored 'General case' 0 C--N 1.345 0.411 0 C-N-CA 122.674 0.389 . . . . 0.0 110.319 179.257 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 10.3 t -82.23 -34.18 28.97 Favored 'General case' 0 C--N 1.34 0.155 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 179.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 89.2 mtt-85 -134.18 69.97 1.46 Allowed 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 178.236 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 87.5 t80 -59.47 111.16 1.29 Allowed 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 116.097 -0.501 . . . . 0.0 109.78 -179.038 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 12.0 t -76.13 173.68 0.93 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 179.31 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -76.89 52.61 0.87 Allowed 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 122.337 0.255 . . . . 0.0 111.455 -178.056 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 69.08 -32.16 0.22 Allowed 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.025 0.93 . . . . 0.0 112.975 177.023 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 51.6 mt-10 -50.87 -61.93 1.91 Allowed 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 118.52 0.6 . . . . 0.0 110.836 -177.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 45.5 m -61.14 -41.19 96.29 Favored 'General case' 0 C--O 1.225 -0.204 0 CA-C-N 116.738 -0.21 . . . . 0.0 110.599 -178.482 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 12.1 ttm180 -56.04 -55.39 33.4 Favored 'General case' 0 CA--C 1.531 0.247 0 N-CA-C 110.286 -0.265 . . . . 0.0 110.286 -179.152 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 21.5 m120 -61.84 -46.05 91.14 Favored 'General case' 0 N--CA 1.455 -0.201 0 N-CA-C 110.282 -0.266 . . . . 0.0 110.282 -179.353 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -56.84 -43.07 80.74 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 122.194 0.198 . . . . 0.0 110.785 -179.12 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 16.4 t -63.43 -57.47 11.72 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.184 0 N-CA-C 110.339 -0.245 . . . . 0.0 110.339 -178.875 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 19.0 m95 -58.87 -37.79 77.35 Favored 'General case' 0 CA--C 1.53 0.197 0 N-CA-C 110.682 -0.118 . . . . 0.0 110.682 -178.466 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -66.02 -53.13 42.52 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 109.953 -0.388 . . . . 0.0 109.953 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.96 -41.62 87.93 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 122.54 0.336 . . . . 0.0 110.893 -178.611 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 19.7 mt -53.37 -46.14 57.67 Favored 'Isoleucine or valine' 0 C--N 1.34 0.194 0 C-N-CA 122.218 0.207 . . . . 0.0 110.547 -179.38 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 7.8 mtpm? -79.82 -37.35 35.28 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 110.303 -0.258 . . . . 0.0 110.303 -177.848 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -59.34 -57.28 13.68 Favored 'General case' 0 N--CA 1.451 -0.379 0 N-CA-C 110.109 -0.33 . . . . 0.0 110.109 -178.523 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -70.91 -43.21 68.76 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 -179.68 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 9.9 t60 65.03 118.72 0.02 OUTLIER 'General case' 0 C--N 1.349 0.567 0 C-N-CA 123.462 0.705 . . . . 0.0 110.091 -178.834 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.49 ' CE2' ' HA ' ' A' ' 4' ' ' ILE . 0.0 OUTLIER . . . . . 0 CA--C 1.53 0.194 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.276 -179.4 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 15.3 tt . . . . . 0 N--CA 1.467 0.404 0 CA-C-O 120.389 0.137 . . . . 0.0 111.214 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 3.6 mmmm -70.19 -58.96 3.19 Favored 'General case' 0 N--CA 1.447 -0.576 0 N-CA-C 110.175 -0.305 . . . . 0.0 110.175 -179.735 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -59.83 -56.75 17.89 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 123.403 0.44 . . . . 0.0 111.749 -176.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 17.1 m -43.55 -56.07 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 C-N-CA 122.83 0.452 . . . . 0.0 112.196 -174.039 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -48.17 -50.24 29.7 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.769 -178.329 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 8.5 mptt -74.66 -34.32 62.69 Favored 'General case' 0 CA--C 1.534 0.347 0 O-C-N 122.436 -0.165 . . . . 0.0 110.736 -178.496 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 11.0 mmt-85 -58.78 -56.19 25.4 Favored 'General case' 0 C--N 1.341 0.205 0 N-CA-C 109.502 -0.555 . . . . 0.0 109.502 179.093 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -68.96 -8.23 42.64 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.688 179.498 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 60.9 63.11 1.33 Allowed 'General case' 0 C--N 1.343 0.291 0 C-N-CA 123.018 0.527 . . . . 0.0 110.254 178.963 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 2.1 m -137.2 -109.48 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.455 -0.191 0 N-CA-C 108.518 -0.919 . . . . 0.0 108.518 177.677 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 10.0 p -169.25 147.05 3.67 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 179.812 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 9.3 t -51.39 -33.06 28.38 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.534 179.552 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 20.2 p -49.83 -54.21 20.76 Favored 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 109.863 -0.421 . . . . 0.0 109.863 179.075 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 10.5 m -53.31 -46.05 69.23 Favored 'General case' 0 N--CA 1.456 -0.151 0 C-N-CA 122.63 0.372 . . . . 0.0 110.094 179.466 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 20.1 t -64.85 -27.08 41.62 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.18 0 CA-C-N 116.433 -0.348 . . . . 0.0 110.824 -178.577 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 45.2 m -77.42 -48.86 16.12 Favored 'General case' 0 CA--C 1.506 -0.732 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 179.844 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 18.2 m-70 -55.54 -39.82 71.08 Favored 'General case' 0 C--O 1.201 -1.47 0 O-C-N 123.329 0.393 . . . . 0.0 110.046 -179.626 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 19.6 t -52.16 -32.89 16.12 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.389 0 CA-C-N 118.192 0.451 . . . . 0.0 110.784 -179.367 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 32.1 mm -75.33 -34.96 31.89 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.415 0 N-CA-C 111.989 0.366 . . . . 0.0 111.989 -177.738 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.3 p-10 -100.56 -40.32 7.47 Favored 'General case' 0 N--CA 1.481 1.097 0 CA-C-N 118.398 0.545 . . . . 0.0 111.337 -176.486 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.448 ' O ' ' CG2' ' A' ' 25' ' ' THR . 36.2 ttpt -153.74 -89.89 0.05 OUTLIER 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 108.13 -1.063 . . . . 0.0 108.13 179.142 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' THR . . . . . 0.448 ' CG2' ' O ' ' A' ' 24' ' ' LYS . 0.8 OUTLIER 173.53 -41.75 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.294 0.637 . . . . 0.0 110.283 177.605 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 38.3 ttt85 57.91 46.12 17.22 Favored 'General case' 0 CA--C 1.535 0.385 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 -178.099 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 22.5 t80 74.19 126.18 0.04 OUTLIER 'General case' 0 C--N 1.346 0.456 0 C-N-CA 123.615 0.766 . . . . 0.0 110.684 -179.804 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 5.8 m -141.96 168.06 15.17 Favored 'Isoleucine or valine' 0 C--N 1.342 0.254 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 178.766 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -100.59 25.78 7.43 Favored 'General case' 0 CA--C 1.531 0.218 0 N-CA-C 109.897 -0.409 . . . . 0.0 109.897 179.38 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 68.5 -65.81 0.26 Allowed 'General case' 0 C--N 1.352 0.684 0 C-N-CA 123.909 0.883 . . . . 0.0 110.704 -179.398 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 68.1 mt-10 -53.54 -33.71 55.59 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 122.775 0.43 . . . . 0.0 110.803 -179.824 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 9.9 p -66.8 -54.81 18.76 Favored 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 -179.374 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 2.4 tmt_? -55.53 -45.64 77.14 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 110.079 -0.341 . . . . 0.0 110.079 179.821 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 86.6 m-20 -64.43 -48.74 74.2 Favored 'General case' 0 CA--C 1.53 0.199 0 N-CA-C 110.493 -0.188 . . . . 0.0 110.493 -179.073 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -58.04 -43.63 86.91 Favored 'General case' 0 C--N 1.34 0.157 0 N-CA-C 110.336 -0.246 . . . . 0.0 110.336 -179.455 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 21.7 t -56.81 -54.21 32.44 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.214 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 179.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 18.0 m95 -60.66 -39.88 90.01 Favored 'General case' 0 N--CA 1.456 -0.154 0 N-CA-C 110.568 -0.16 . . . . 0.0 110.568 -179.532 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -58.83 -52.37 66.01 Favored 'General case' 0 N--CA 1.455 -0.193 0 N-CA-C 109.946 -0.39 . . . . 0.0 109.946 -179.067 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -62.62 -44.52 96.08 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 122.294 0.238 . . . . 0.0 110.508 -179.774 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 29.4 mt -58.12 -39.11 71.45 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.196 0 N-CA-C 110.247 -0.279 . . . . 0.0 110.247 -179.658 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 65.2 mmtt -78.1 -34.11 50.27 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 109.925 -0.398 . . . . 0.0 109.925 -178.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -63.85 -58.48 6.66 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 110.407 -0.22 . . . . 0.0 110.407 -178.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 79.2 mt -85.62 -2.13 57.85 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 122.223 0.209 . . . . 0.0 110.913 -178.547 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 4.4 m-70 63.71 13.37 7.34 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 123.137 0.575 . . . . 0.0 110.767 -179.42 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 7.6 t80 . . . . . 0 C--N 1.347 0.472 0 C-N-CA 124.035 0.934 . . . . 0.0 111.153 -178.7 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.536 0.437 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 27.1 mmtp -59.52 -58.79 7.04 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 120.733 0.301 . . . . 0.0 110.381 -178.552 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -57.36 -50.64 72.32 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.624 -179.121 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 29.3 t -53.66 -54.51 18.74 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.092 0 C-N-CA 123.045 0.538 . . . . 0.0 110.491 -179.715 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -55.09 -58.61 6.95 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.728 -177.332 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 32.6 mtmm -59.63 -34.57 72.95 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 110.422 -0.214 . . . . 0.0 110.422 -177.775 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 49.2 tpt85 -64.91 -35.12 80.13 Favored 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 177.061 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -84.56 8.21 17.42 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 122.691 0.396 . . . . 0.0 110.256 178.236 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 8.1 t-20 69.98 42.42 1.02 Allowed 'General case' 0 C--N 1.346 0.447 0 C-N-CA 123.974 0.909 . . . . 0.0 111.454 177.424 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 3.6 m -145.16 143.35 22.27 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.518 0 N-CA-C 108.21 -1.033 . . . . 0.0 108.21 176.03 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 74.3 m -71.7 -65.65 0.73 Allowed 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.865 -0.42 . . . . 0.0 109.865 -178.257 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 5.2 t 179.71 -33.02 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 123.964 0.905 . . . . 0.0 108.869 -179.753 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 11.7 p -57.84 -49.08 77.89 Favored 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 178.272 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 12.0 m -56.76 -36.09 69.4 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 110.228 -0.286 . . . . 0.0 110.228 179.215 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 71.6 t -69.99 -38.47 75.42 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.178 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 178.218 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 17.4 m -61.66 -33.36 73.84 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 109.755 -0.461 . . . . 0.0 109.755 179.152 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 50.8 m170 -61.29 -30.48 70.51 Favored 'General case' 0 C--N 1.346 0.431 0 N-CA-C 110.385 -0.228 . . . . 0.0 110.385 179.496 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 93.1 t -63.96 -52.04 61.67 Favored 'Isoleucine or valine' 0 C--N 1.341 0.215 0 N-CA-C 109.522 -0.547 . . . . 0.0 109.522 179.911 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 4.8 mm -64.41 -49.96 78.42 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.164 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 179.656 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 33.8 t-20 -59.86 -31.75 70.06 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 116.528 -0.305 . . . . 0.0 110.205 -179.262 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 31.9 ttpt 64.34 46.02 3.61 Favored 'General case' 0 CA--C 1.532 0.282 0 N-CA-C 109.503 -0.555 . . . . 0.0 109.503 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 15.2 p -115.55 -87.06 0.6 Allowed 'General case' 0 C--N 1.341 0.233 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 -179.847 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 47.5 mmm-85 -94.73 54.6 1.78 Allowed 'General case' 0 C--O 1.233 0.22 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 -179.34 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 27.6 p90 -72.57 144.24 47.98 Favored 'General case' 0 N--CA 1.453 -0.287 0 N-CA-C 109.379 -0.601 . . . . 0.0 109.379 179.7 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 19.7 t -87.54 80.1 1.77 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.286 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 -179.548 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 54.55 -143.33 0.74 Allowed 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.203 179.397 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 69.1 mt-10 -115.05 -25.27 8.2 Favored 'General case' 0 CA--C 1.528 0.125 0 C-N-CA 122.892 0.477 . . . . 0.0 110.284 179.705 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 70.0 mm-40 -55.24 -61.8 2.09 Favored 'General case' 0 C--O 1.232 0.163 0 N-CA-C 110.148 -0.315 . . . . 0.0 110.148 -179.783 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 9.6 m -62.65 -40.1 95.96 Favored 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 179.925 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 13.9 ttm180 -52.03 -48.96 64.3 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 122.701 0.4 . . . . 0.0 110.308 -179.657 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 22.4 t-20 -71.09 -47.52 57.76 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.336 -179.174 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -54.63 -39.79 68.31 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 122.42 0.288 . . . . 0.0 110.945 -178.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 17.5 t -60.39 -60.88 1.91 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.279 0 N-CA-C 109.84 -0.43 . . . . 0.0 109.84 -179.524 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 26.0 m95 -58.34 -37.33 74.94 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-O 119.969 -0.062 . . . . 0.0 110.946 -178.196 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -61.37 -55.93 26.07 Favored 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 109.808 -0.442 . . . . 0.0 109.808 179.069 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.5 -42.49 87.78 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 122.611 0.364 . . . . 0.0 110.895 -179.033 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 27.4 mt -52.71 -56.87 5.51 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.193 0 C-N-CA 122.54 0.336 . . . . 0.0 110.703 -178.779 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -83.67 0.09 48.47 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-O 119.6 -0.238 . . . . 0.0 111.541 -176.818 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.6 tm-20 -88.7 -46.48 8.98 Favored 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 109.181 -0.674 . . . . 0.0 109.181 179.435 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 6.9 mt -72.38 -92.32 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 119.27 -0.395 . . . . 0.0 110.71 -178.514 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 54.9 m80 -158.79 18.0 0.2 Allowed 'General case' 0 C--N 1.352 0.694 0 N-CA-C 112.763 0.653 . . . . 0.0 112.763 -175.608 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 66.7 t80 . . . . . 0 N--CA 1.464 0.234 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 179.003 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.1 mt . . . . . 0 CA--C 1.541 0.625 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -82.29 -58.06 3.1 Favored 'General case' 0 N--CA 1.45 -0.454 0 C-N-CA 123.412 0.685 . . . . 0.0 110.41 -177.588 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 32.9 m-20 -82.23 -34.24 28.95 Favored 'General case' 0 C--O 1.224 -0.268 0 N-CA-C 110.377 -0.231 . . . . 0.0 110.377 -177.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 31.2 t -54.16 -52.56 36.48 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.259 0 N-CA-C 110.092 -0.336 . . . . 0.0 110.092 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.65 -45.73 88.84 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-O 120.499 0.19 . . . . 0.0 110.663 -178.853 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 18.3 mmtp -67.1 -24.71 65.96 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-O 119.614 -0.231 . . . . 0.0 111.224 -178.132 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 1.6 tmm_? -60.65 -43.61 97.38 Favored 'General case' 0 C--N 1.343 0.316 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 177.887 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -85.18 -0.28 54.08 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 178.466 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 67.39 48.73 1.11 Allowed 'General case' 0 C--N 1.345 0.411 0 C-N-CA 123.202 0.601 . . . . 0.0 110.268 178.651 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 27.6 m -143.22 174.1 5.28 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 178.531 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 21.3 m -88.69 161.84 16.62 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 122.672 0.389 . . . . 0.0 110.074 -179.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 14.1 t -56.4 -32.35 64.73 Favored 'General case' 0 N--CA 1.463 0.223 0 C-N-CA 122.509 0.324 . . . . 0.0 110.763 -179.851 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 13.8 p -58.86 -45.62 89.69 Favored 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 178.823 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -55.94 -42.35 76.03 Favored 'General case' 0 N--CA 1.453 -0.278 0 N-CA-C 109.884 -0.413 . . . . 0.0 109.884 179.612 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 78.5 t -64.87 -43.47 96.33 Favored 'Isoleucine or valine' 0 C--N 1.34 0.177 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 179.185 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 14.4 t -57.67 -37.25 73.09 Favored 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 110.151 -0.314 . . . . 0.0 110.151 179.622 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 54.7 m170 -59.13 -28.07 66.21 Favored 'General case' 0 C--N 1.344 0.332 0 N-CA-C 110.398 -0.223 . . . . 0.0 110.398 -179.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 36.7 t -77.79 -43.69 29.0 Favored 'Isoleucine or valine' 0 C--O 1.232 0.154 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 178.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 77.2 mt -57.98 -58.42 6.44 Favored 'Isoleucine or valine' 0 C--N 1.34 0.163 0 N-CA-C 109.519 -0.548 . . . . 0.0 109.519 -179.436 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 26.5 p30 -73.84 -14.42 61.08 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 110.283 -0.266 . . . . 0.0 110.283 -179.849 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 62.22 32.63 17.15 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 122.978 0.511 . . . . 0.0 111.254 177.035 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 14.8 t -70.23 -29.32 66.12 Favored 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 177.56 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 74.3 mtt85 -141.81 98.33 3.32 Favored 'General case' 0 C--N 1.343 0.309 0 N-CA-C 108.115 -1.069 . . . . 0.0 108.115 178.148 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 88.5 t80 -65.88 108.6 2.21 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 110.234 -0.284 . . . . 0.0 110.234 -178.601 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 30.3 m -72.82 172.88 0.96 Allowed 'Isoleucine or valine' 0 N--CA 1.457 -0.118 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 178.235 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -65.03 159.3 23.44 Favored 'General case' 0 N--CA 1.449 -0.477 0 N-CA-C 109.684 -0.487 . . . . 0.0 109.684 178.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 29.5 mm-40 -50.63 -43.01 56.86 Favored 'General case' 0 C--O 1.223 -0.336 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.155 179.473 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 9.5 tm-20 -52.17 -53.23 45.68 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 122.217 0.207 . . . . 0.0 110.632 -179.364 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 10.0 m -65.55 -52.66 50.75 Favored 'General case' 0 N--CA 1.442 -0.855 0 CA-C-O 119.593 -0.242 . . . . 0.0 111.453 -175.25 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 6.8 ppt_? -62.19 -39.51 92.97 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 118.277 0.49 . . . . 0.0 110.958 -176.784 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 49.2 m-80 -67.17 -46.61 73.47 Favored 'General case' 0 C--N 1.34 0.194 0 N-CA-C 109.549 -0.537 . . . . 0.0 109.549 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -58.64 -42.01 87.36 Favored 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 110.21 -0.293 . . . . 0.0 110.21 179.717 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 18.8 t -63.94 -58.3 7.92 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.216 0 C-N-CA 122.381 0.272 . . . . 0.0 110.314 -179.514 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 19.3 m95 -57.87 -37.76 74.51 Favored 'General case' 0 C--N 1.342 0.261 0 N-CA-C 110.444 -0.206 . . . . 0.0 110.444 -178.371 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -64.13 -52.55 58.59 Favored 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 179.266 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -55.74 -45.46 78.0 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 122.449 0.3 . . . . 0.0 111.038 -178.602 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 46.5 mt -55.26 -43.53 71.33 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 C-N-CA 122.2 0.2 . . . . 0.0 110.985 -178.116 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 36.6 mtmm -78.32 -43.54 27.61 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 109.983 -0.377 . . . . 0.0 109.983 -177.541 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 24.0 mm-40 -57.15 -47.77 80.36 Favored 'General case' 0 N--CA 1.448 -0.542 0 O-C-N 123.152 0.282 . . . . 0.0 110.761 -178.466 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -85.52 -0.68 55.69 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-O 119.669 -0.205 . . . . 0.0 110.636 -178.876 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 21.2 m80 57.14 38.47 29.01 Favored 'General case' 0 C--N 1.345 0.406 0 C-N-CA 122.651 0.38 . . . . 0.0 110.689 178.687 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 1.5 m-85 . . . . . 0 C--N 1.327 -0.397 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.258 179.791 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 21.3 tt . . . . . 0 C--O 1.226 -0.177 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -60.47 -60.25 4.11 Favored 'General case' 0 N--CA 1.447 -0.608 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 178.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 29.2 m-20 -54.22 -43.36 70.75 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.262 179.379 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 42.8 t -59.53 -36.67 66.12 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.28 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 178.409 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -68.11 -40.04 82.63 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 110.273 -0.269 . . . . 0.0 110.273 179.755 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 52.9 mttt -62.48 -40.44 96.69 Favored 'General case' 0 C--N 1.343 0.289 0 N-CA-C 108.485 -0.931 . . . . 0.0 108.485 177.733 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 27.1 mtt180 -60.03 -43.58 95.2 Favored 'General case' 0 C--N 1.341 0.229 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 176.415 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -73.77 9.85 1.33 Allowed 'General case' 0 CA--C 1.541 0.635 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.632 177.023 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 8.1 m-80 75.07 149.19 0.1 Allowed 'General case' 0 C--N 1.353 0.739 0 C-N-CA 124.296 1.038 . . . . 0.0 111.613 177.199 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 40.8 t 64.02 -86.6 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.455 -0.18 0 CA-C-N 114.393 -1.276 . . . . 0.0 110.559 177.116 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 9.3 t -174.88 -162.74 0.12 Allowed 'General case' 0 C--O 1.233 0.234 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 -177.045 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 20.0 p -57.91 -19.93 33.49 Favored 'General case' 0 C--O 1.222 -0.347 0 C-N-CA 123.133 0.573 . . . . 0.0 111.314 -179.282 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 4.6 m -53.5 -49.51 67.38 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 110.277 -0.268 . . . . 0.0 110.277 179.668 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 26.1 m -62.4 -44.3 96.78 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 110.296 -0.261 . . . . 0.0 110.296 -179.289 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 92.6 t -61.29 -42.25 92.84 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 -179.839 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 50.3 m -61.3 -40.72 95.21 Favored 'General case' 0 N--CA 1.454 -0.243 0 N-CA-C 110.159 -0.311 . . . . 0.0 110.159 -179.496 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 47.0 m170 -59.36 -41.3 88.93 Favored 'General case' 0 C--N 1.339 0.149 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 -179.825 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 54.0 t -70.47 -52.48 28.93 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 O-C-N 123.035 0.21 . . . . 0.0 110.791 -178.674 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 93.1 mt -63.44 -51.87 65.22 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 N-CA-C 110.393 -0.225 . . . . 0.0 110.393 -177.635 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 14.6 t-20 -68.56 -34.88 76.6 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-O 119.665 -0.207 . . . . 0.0 110.517 -178.483 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 23.1 mtmm 70.56 60.09 0.22 Allowed 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 123.373 0.669 . . . . 0.0 109.507 -179.398 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 19.3 p -87.33 -80.35 0.26 Allowed 'General case' 0 C--N 1.34 0.167 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 179.201 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 8.7 ptm180 -86.76 163.1 17.48 Favored 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 109.843 -0.429 . . . . 0.0 109.843 179.41 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 89.1 t80 -80.99 142.25 33.62 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 179.617 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 9.0 m -141.17 158.19 22.61 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.183 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 178.544 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -73.22 160.2 32.28 Favored 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 179.499 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 15.1 mm-40 -58.53 -24.38 60.47 Favored 'General case' 0 C--O 1.223 -0.298 0 N-CA-C 110.099 -0.334 . . . . 0.0 110.099 179.071 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.7 tm-20 -56.21 -53.01 62.28 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 109.705 -0.48 . . . . 0.0 109.705 178.034 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 3.9 m -64.03 -48.68 75.35 Favored 'General case' 0 N--CA 1.449 -0.517 0 C-N-CA 122.247 0.219 . . . . 0.0 110.477 -177.487 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 28.3 mtm180 -57.84 -54.25 48.99 Favored 'General case' 0 CA--C 1.528 0.119 0 N-CA-C 110.051 -0.351 . . . . 0.0 110.051 -179.16 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 48.6 t30 -57.73 -48.82 78.51 Favored 'General case' 0 C--O 1.224 -0.272 0 C-N-CA 122.785 0.434 . . . . 0.0 110.339 -178.828 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -55.85 -47.16 77.77 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 122.112 0.165 . . . . 0.0 110.651 -178.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 39.2 t -63.44 -56.4 17.29 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.15 0 N-CA-C 110.474 -0.195 . . . . 0.0 110.474 -178.82 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 19.5 m95 -57.21 -40.19 76.99 Favored 'General case' 0 C--O 1.233 0.202 0 N-CA-C 110.516 -0.179 . . . . 0.0 110.516 -178.56 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -64.09 -49.59 71.65 Favored 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 -179.781 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -70.44 0.15 7.21 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-O 119.499 -0.286 . . . . 0.0 111.536 -178.68 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 21.8 mt -102.91 -46.72 10.83 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.195 0 N-CA-C 109.899 -0.408 . . . . 0.0 109.899 178.895 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 1.1 ttpm? -93.19 -30.35 15.26 Favored 'General case' 0 C--N 1.343 0.318 0 N-CA-C 112.25 0.463 . . . . 0.0 112.25 -176.078 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 49.5 mm-40 -86.46 -30.56 21.93 Favored 'General case' 0 C--N 1.34 0.172 0 CA-C-N 118.371 0.532 . . . . 0.0 110.558 -177.72 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -73.76 -29.1 62.02 Favored 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 110.356 -0.239 . . . . 0.0 110.356 -179.323 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 19.1 m80 59.57 57.73 3.16 Favored 'General case' 0 C--N 1.346 0.426 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 -179.481 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 9.2 p90 . . . . . 0 C--N 1.319 -0.739 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.896 -178.631 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.221 -0.406 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 28.9 mtpp -58.51 -64.92 0.75 Allowed 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 122.492 0.317 . . . . 0.0 110.757 -178.763 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -58.9 -44.85 91.28 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.64 -0.254 . . . . 0.0 110.623 -179.379 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 53.5 t -56.53 -45.2 82.07 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 179.577 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.6 -45.09 91.92 Favored 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 110.397 -0.224 . . . . 0.0 110.397 -179.74 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 34.9 mtmm -58.55 -41.49 85.71 Favored 'General case' 0 C--N 1.341 0.237 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 178.512 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.43 -35.23 76.98 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 108.748 -0.834 . . . . 0.0 108.748 177.911 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -88.58 15.64 7.76 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.471 178.458 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 64.2 t30 85.26 145.91 0.06 Allowed 'General case' 0 C--N 1.353 0.738 0 C-N-CA 124.281 1.032 . . . . 0.0 111.487 177.74 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 4.9 t 65.24 -116.6 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.471 0 CA-C-N 114.907 -1.042 . . . . 0.0 109.814 178.461 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 7.9 t -166.25 -161.69 0.49 Allowed 'General case' 0 C--N 1.344 0.341 0 CA-C-N 118.491 0.587 . . . . 0.0 110.247 -178.758 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 39.1 p -54.26 -23.32 14.41 Favored 'General case' 0 C--N 1.342 0.261 0 C-N-CA 123.189 0.596 . . . . 0.0 111.744 -177.881 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 13.2 t -56.2 -38.53 71.11 Favored 'General case' 0 C--O 1.222 -0.385 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 179.257 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 58.0 m -65.72 -35.32 80.42 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 109.922 -0.399 . . . . 0.0 109.922 179.767 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 62.3 t -69.98 -52.71 28.48 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.336 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 179.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 85.3 p -53.42 -40.31 65.02 Favored 'General case' 0 C--N 1.343 0.298 0 N-CA-C 110.524 -0.176 . . . . 0.0 110.524 -178.634 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 57.7 m170 -54.05 -36.41 63.04 Favored 'General case' 0 C--N 1.345 0.386 0 C-N-CA 122.27 0.228 . . . . 0.0 110.396 179.112 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 59.2 t -78.49 -35.02 18.57 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.224 0 CA-C-N 116.687 -0.233 . . . . 0.0 110.397 -179.288 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 25.5 mm -67.23 -50.84 59.4 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.218 0 CA-C-N 117.889 0.313 . . . . 0.0 110.214 -179.285 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 34.6 p30 -87.27 -8.67 56.52 Favored 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 111.674 0.25 . . . . 0.0 111.674 -177.645 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 54.25 36.75 25.84 Favored 'General case' 0 C--N 1.345 0.399 0 C-N-CA 122.616 0.367 . . . . 0.0 110.388 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 7.0 t -82.12 -30.1 31.34 Favored 'General case' 0 CA--C 1.531 0.247 0 N-CA-C 110.307 -0.257 . . . . 0.0 110.307 -179.291 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 60.1 mtp85 -128.31 116.95 20.61 Favored 'General case' 0 C--N 1.344 0.344 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 47.4 t80 -71.72 108.38 5.02 Favored 'General case' 0 N--CA 1.453 -0.285 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 -179.668 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 4.6 m -107.35 38.55 0.37 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.376 0 C-N-CA 122.551 0.341 . . . . 0.0 110.549 -178.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 60.73 -179.91 0.1 Allowed 'General case' 0 C--N 1.343 0.302 0 CA-C-O 121.111 0.482 . . . . 0.0 111.179 178.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 58.1 mm-40 -77.77 -25.64 49.23 Favored 'General case' 0 C--O 1.223 -0.298 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.286 179.693 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -58.3 -64.92 0.75 Allowed 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 110.471 -0.196 . . . . 0.0 110.471 -178.666 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 2.2 m -61.26 -44.29 97.48 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 110.091 -0.337 . . . . 0.0 110.091 -178.674 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 44.1 ttm105 -53.54 -55.8 22.49 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 122.826 0.451 . . . . 0.0 110.613 -179.336 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -63.36 -48.03 79.65 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 122.424 0.289 . . . . 0.0 110.496 -178.873 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.65 -47.32 70.46 Favored 'General case' 0 C--N 1.34 0.157 0 C-N-CA 122.187 0.195 . . . . 0.0 110.674 -178.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 37.9 t -62.78 -57.41 12.16 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.223 0 N-CA-C 110.173 -0.306 . . . . 0.0 110.173 -179.484 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 13.1 m95 -56.57 -32.13 64.89 Favored 'General case' 0 C--N 1.343 0.283 0 CA-C-N 117.463 0.119 . . . . 0.0 110.946 -178.235 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -71.59 -67.48 0.52 Allowed 'General case' 0 N--CA 1.447 -0.581 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 179.075 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -48.08 -40.54 23.58 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 122.692 0.397 . . . . 0.0 111.555 -178.11 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 1.5 mm -44.71 -54.4 1.23 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.206 0 C-N-CA 123.095 0.558 . . . . 0.0 111.27 -178.326 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 24.3 pttm -100.84 -31.78 10.99 Favored 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 112.187 0.44 . . . . 0.0 112.187 -176.112 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 76.1 mm-40 -73.5 -40.19 64.25 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 118.04 0.382 . . . . 0.0 110.989 -176.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.0 tt -77.33 -36.43 53.93 Favored 'General case' 0 CA--C 1.527 0.084 0 N-CA-C 110.179 -0.304 . . . . 0.0 110.179 -178.688 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 15.2 m80 76.93 134.28 0.06 Allowed 'General case' 0 C--N 1.346 0.444 0 C-N-CA 123.619 0.768 . . . . 0.0 109.735 -178.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 3.7 p90 . . . . . 0 CA--C 1.532 0.272 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 178.301 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.224 -0.286 0 N-CA-C 110.246 -0.279 . . . . 0.0 110.246 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 58.2 mtmt -48.43 -63.05 1.19 Allowed 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 122.947 0.499 . . . . 0.0 110.583 179.41 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -58.38 -44.97 89.15 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.722 -178.45 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 97.1 t -57.12 -43.34 81.27 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.184 0 N-CA-C 110.319 -0.252 . . . . 0.0 110.319 -179.168 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.71 -40.08 93.78 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 122.386 0.275 . . . . 0.0 110.715 -178.702 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -64.65 -49.32 71.47 Favored 'General case' 0 C--O 1.227 -0.125 0 N-CA-C 109.521 -0.548 . . . . 0.0 109.521 179.447 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.38 -31.76 73.1 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.258 179.844 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -71.41 -53.22 14.79 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 122.241 0.216 . . . . 0.0 110.635 -178.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 42.7 t30 -147.94 -82.65 0.12 Allowed 'General case' 0 C--N 1.342 0.264 0 CA-C-O 119.682 -0.199 . . . . 0.0 111.06 -177.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 95.2 t -140.68 -66.87 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.348 0.514 0 CA-C-N 117.68 0.218 . . . . 0.0 110.911 -176.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 74.4 m -132.43 172.48 12.42 Favored 'General case' 0 C--N 1.344 0.365 0 CA-C-O 120.995 0.426 . . . . 0.0 110.892 -176.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 43.0 p -53.91 -31.72 51.04 Favored 'General case' 0 C--O 1.223 -0.314 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.438 -178.696 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 12.8 t -49.4 -44.8 45.45 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 122.099 0.159 . . . . 0.0 110.936 -178.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 6.6 m -57.52 -28.83 63.82 Favored 'General case' 0 C--N 1.342 0.281 0 CA-C-O 119.687 -0.197 . . . . 0.0 111.116 -178.756 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 40.2 t -88.33 -37.08 9.99 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.223 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 179.098 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 25.4 m -57.08 -45.86 82.97 Favored 'General case' 0 CA--C 1.519 -0.233 0 C-N-CA 122.474 0.31 . . . . 0.0 110.473 -177.347 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 52.9 m-70 -56.13 -43.16 77.93 Favored 'General case' 0 C--O 1.209 -1.064 0 N-CA-C 110.177 -0.305 . . . . 0.0 110.177 -179.497 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 3.2 t -58.27 -29.5 37.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 O-C-N 121.9 -0.5 . . . . 0.0 112.325 -176.204 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 2.7 mt -79.85 -29.41 12.89 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.462 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 -176.239 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 6.4 p30 -117.37 -33.7 4.54 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 118.613 0.642 . . . . 0.0 112.168 -175.488 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 174.08 102.9 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 -177.521 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 65.5 p -48.83 -33.34 10.32 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 112.722 0.638 . . . . 0.0 112.722 -177.609 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 74.68 -164.0 0.08 Allowed 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 -177.148 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.1 t80 -79.24 96.14 5.84 Favored 'General case' 0 CA--C 1.531 0.232 0 O-C-N 122.249 -0.282 . . . . 0.0 110.779 -178.209 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 1.6 m -149.22 151.21 13.2 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.236 0 N-CA-C 108.576 -0.898 . . . . 0.0 108.576 176.9 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.88 153.66 42.99 Favored 'General case' 0 N--CA 1.447 -0.605 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 178.855 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 38.3 mp0 -55.21 -34.09 63.64 Favored 'General case' 0 CA--C 1.527 0.088 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 179.589 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -53.84 -41.84 67.84 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 122.66 0.384 . . . . 0.0 110.804 -179.857 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 1.7 m -66.22 -22.73 66.35 Favored 'General case' 0 C--N 1.346 0.432 0 N-CA-C 110.234 -0.284 . . . . 0.0 110.234 -178.202 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 3.0 mmp_? -85.07 -47.03 10.59 Favored 'General case' 0 C--N 1.343 0.312 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 179.762 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 28.2 m120 -54.19 -43.66 70.91 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 179.51 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -58.02 -41.61 83.51 Favored 'General case' 0 N--CA 1.453 -0.307 0 O-C-N 123.165 0.291 . . . . 0.0 111.317 -179.523 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 38.4 t -66.16 -57.17 11.5 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.195 0 CA-C-N 117.609 0.186 . . . . 0.0 110.551 -177.919 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 33.9 m95 -65.45 -30.77 71.6 Favored 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 110.719 -0.104 . . . . 0.0 110.719 -177.315 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -67.24 -51.12 57.05 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 177.505 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.23 -41.55 84.36 Favored 'General case' 0 C--N 1.342 0.266 0 C-N-CA 122.362 0.265 . . . . 0.0 110.334 179.74 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 3.2 mm -54.39 -50.82 54.53 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.272 0 C-N-CA 122.788 0.435 . . . . 0.0 110.315 179.782 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 20.4 tptm -74.11 -33.16 63.49 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 110.243 -0.28 . . . . 0.0 110.243 -178.014 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -63.96 -63.35 1.18 Allowed 'General case' 0 N--CA 1.448 -0.539 0 C-N-CA 122.368 0.267 . . . . 0.0 110.947 -177.61 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 82.3 mt -83.49 -20.79 33.32 Favored 'General case' 0 C--N 1.338 0.088 0 CA-C-O 119.47 -0.3 . . . . 0.0 111.503 -176.768 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 73.87 138.47 0.06 Allowed 'General case' 0 C--N 1.345 0.407 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 -178.279 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 8.7 t80 . . . . . 0 C--N 1.333 -0.126 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 179.487 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 33.9 pt . . . . . 0 N--CA 1.443 -0.776 0 N-CA-C 109.673 -0.491 . . . . 0.0 109.673 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 36.5 mtpt -65.71 -63.11 1.17 Allowed 'General case' 0 N--CA 1.448 -0.536 0 N-CA-C 109.549 -0.537 . . . . 0.0 109.549 179.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -49.41 -49.83 43.19 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.447 178.843 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 64.4 t -58.78 -51.75 68.33 Favored 'Isoleucine or valine' 0 C--N 1.341 0.224 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.299 -179.239 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -55.6 -54.56 42.62 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 122.28 0.232 . . . . 0.0 110.64 -178.726 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 61.9 mtpt -58.83 -38.85 79.61 Favored 'General case' 0 N--CA 1.453 -0.283 0 O-C-N 123.113 0.258 . . . . 0.0 110.457 -178.371 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 14.1 tpt180 -63.41 -36.82 84.98 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 177.701 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -82.75 7.86 13.83 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 122.417 0.287 . . . . 0.0 110.241 177.862 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 76.53 -35.79 0.25 Allowed 'General case' 0 C--N 1.35 0.591 0 C-N-CA 124.144 0.977 . . . . 0.0 111.888 177.823 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -78.05 -170.99 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 CA-C-N 118.321 0.509 . . . . 0.0 110.384 -178.003 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 11.2 t -102.93 179.78 4.18 Favored 'General case' 0 C--N 1.345 0.372 0 C-N-CA 122.824 0.45 . . . . 0.0 110.439 -178.468 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 19.4 p -58.02 -29.21 65.14 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 123.106 0.562 . . . . 0.0 111.644 -177.372 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 12.5 t -53.91 -38.23 64.62 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 117.814 0.279 . . . . 0.0 110.667 -179.298 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 87.2 m -67.4 -36.68 81.78 Favored 'General case' 0 N--CA 1.451 -0.393 0 O-C-N 122.168 -0.332 . . . . 0.0 110.152 -179.361 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 66.7 t -73.96 -41.02 53.0 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 N-CA-C 109.931 -0.396 . . . . 0.0 109.931 -179.62 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 94.0 p -59.88 -41.31 91.28 Favored 'General case' 0 N--CA 1.453 -0.278 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 179.021 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 55.2 m170 -56.5 -35.45 68.03 Favored 'General case' 0 C--N 1.346 0.436 0 N-CA-C 110.085 -0.339 . . . . 0.0 110.085 177.827 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 99.4 t -72.94 -57.79 6.27 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.162 0 C-N-CA 122.376 0.27 . . . . 0.0 110.68 -177.714 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 34.2 mm -57.0 -48.46 81.69 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.157 0 N-CA-C 110.368 -0.234 . . . . 0.0 110.368 -177.509 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 34.9 m-80 -73.8 -28.86 61.85 Favored 'General case' 0 CA--C 1.53 0.192 0 N-CA-C 110.496 -0.187 . . . . 0.0 110.496 -179.27 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 34.3 ttpt 57.01 53.72 7.72 Favored 'General case' 0 C--N 1.344 0.327 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 -179.124 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 13.9 t -108.46 -43.3 4.35 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.849 -177.432 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 27.0 tpt180 -85.54 109.66 18.67 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 109.408 -0.59 . . . . 0.0 109.408 -179.013 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 66.4 t80 -64.64 144.68 57.05 Favored 'General case' 0 N--CA 1.456 -0.149 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.268 -179.802 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 5.5 m -147.81 -171.05 0.25 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 -179.567 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -85.53 28.89 0.72 Allowed 'General case' 0 CA--C 1.539 0.526 0 CA-C-O 119.621 -0.228 . . . . 0.0 111.322 -179.325 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 72.56 -65.64 0.34 Allowed 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 123.427 0.691 . . . . 0.0 111.564 178.086 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -42.76 -47.13 5.39 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.355 0.662 . . . . 0.0 111.599 -176.872 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 6.6 m -50.48 -39.95 49.62 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 122.426 0.29 . . . . 0.0 111.026 -179.195 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 3.4 mpt_? -82.38 -42.45 18.64 Favored 'General case' 0 N--CA 1.46 0.058 0 N-CA-C 109.992 -0.373 . . . . 0.0 109.992 -178.789 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 20.2 t30 -54.41 -43.45 71.5 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 110.014 -0.365 . . . . 0.0 110.014 179.364 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -56.98 -49.0 77.09 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 122.537 0.335 . . . . 0.0 110.272 179.858 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 84.8 t -62.85 -49.28 84.28 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 N-CA-C 109.824 -0.436 . . . . 0.0 109.824 179.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 18.4 m95 -53.84 -40.27 66.31 Favored 'General case' 0 C--N 1.341 0.236 0 N-CA-C 110.05 -0.352 . . . . 0.0 110.05 179.767 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -66.55 -47.59 72.36 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 178.41 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -53.75 -39.57 65.45 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 122.425 0.29 . . . . 0.0 110.974 -179.482 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 1.1 mp -53.69 -39.75 39.84 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.384 0 N-CA-C 110.231 -0.285 . . . . 0.0 110.231 179.792 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 57.4 tptt -86.71 -40.25 15.23 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 122.244 0.218 . . . . 0.0 110.744 -177.328 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 47.2 mm-40 -61.68 -51.8 66.94 Favored 'General case' 0 N--CA 1.456 -0.175 0 N-CA-C 110.04 -0.355 . . . . 0.0 110.04 -177.696 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 61.3 tp -83.78 -82.54 0.16 Allowed 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 179.571 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 2.5 p-80 161.8 145.31 0.01 OUTLIER 'General case' 0 C--N 1.345 0.372 0 C-N-CA 124.24 1.016 . . . . 0.0 108.589 -179.835 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 29.5 t80 . . . . . 0 C--N 1.329 -0.294 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 178.887 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 20.2 tt . . . . . 0 C--O 1.223 -0.304 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 9.0 mtmp? -59.75 -65.84 0.61 Allowed 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 122.575 0.35 . . . . 0.0 110.125 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -54.96 -51.3 66.61 Favored 'General case' 0 N--CA 1.456 -0.147 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.513 -178.698 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 55.0 t -55.99 -49.86 72.92 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 C-N-CA 122.658 0.383 . . . . 0.0 110.643 -178.196 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.0 -50.47 70.61 Favored 'General case' 0 N--CA 1.456 -0.168 0 C-N-CA 122.175 0.19 . . . . 0.0 111.186 -177.743 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 41.9 tttm -62.08 -36.03 80.46 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 122.071 0.149 . . . . 0.0 110.624 -178.024 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 21.7 tpp180 -72.44 -41.25 66.36 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 109.754 -0.462 . . . . 0.0 109.754 179.588 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -64.89 -57.42 8.85 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 122.541 0.337 . . . . 0.0 111.129 -178.384 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 22.1 m120 -135.74 -121.36 0.16 Allowed 'General case' 0 C--N 1.342 0.253 0 N-CA-C 110.299 -0.26 . . . . 0.0 110.299 -177.22 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 94.5 t -87.69 -58.8 3.17 Favored 'Isoleucine or valine' 0 C--N 1.342 0.266 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 -178.351 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 52.4 p -167.48 -164.04 0.56 Allowed 'General case' 0 C--O 1.232 0.155 0 N-CA-C 109.912 -0.403 . . . . 0.0 109.912 -179.06 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 27.9 m -56.88 -27.39 60.45 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.557 179.914 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 23.5 p -59.79 -54.56 44.81 Favored 'General case' 0 C--N 1.341 0.236 0 N-CA-C 110.068 -0.345 . . . . 0.0 110.068 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -62.57 -20.91 65.17 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-O 119.52 -0.276 . . . . 0.0 111.084 -179.337 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 39.4 t -82.04 -53.27 12.29 Favored 'Isoleucine or valine' 0 C--N 1.34 0.178 0 CA-C-N 118.028 0.377 . . . . 0.0 110.035 179.272 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 84.2 p -50.87 -38.42 49.35 Favored 'General case' 0 C--N 1.342 0.268 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 -179.325 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 58.1 m170 -50.22 -39.82 45.58 Favored 'General case' 0 CA--C 1.529 0.166 0 O-C-N 123.266 0.353 . . . . 0.0 110.227 178.344 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 3.7 t -84.81 -53.97 9.65 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.167 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.032 -178.679 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 31.6 mm -55.22 -50.33 65.25 Favored 'Isoleucine or valine' 0 C--N 1.343 0.307 0 O-C-N 122.797 0.061 . . . . 0.0 110.918 -175.788 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 25.5 t30 -82.42 -3.2 55.21 Favored 'General case' 0 CA--C 1.533 0.305 0 N-CA-C 110.175 -0.306 . . . . 0.0 110.175 -178.498 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 52.8 mtmt 55.19 37.82 29.48 Favored 'General case' 0 C--N 1.347 0.466 0 N-CA-C 108.839 -0.801 . . . . 0.0 108.839 -178.294 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.9 -32.47 73.74 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 115.567 -0.742 . . . . 0.0 109.885 -178.877 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 15.6 ptp180 -157.48 145.05 18.69 Favored 'General case' 0 N--CA 1.452 -0.362 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 179.007 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 30.8 t80 -79.66 92.12 5.33 Favored 'General case' 0 N--CA 1.455 -0.214 0 N-CA-C 109.752 -0.462 . . . . 0.0 109.752 -178.812 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 11.7 m -72.75 163.58 3.88 Favored 'Isoleucine or valine' 0 C--O 1.233 0.22 0 N-CA-C 109.92 -0.4 . . . . 0.0 109.92 178.845 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -65.35 157.03 30.32 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 178.142 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -53.92 -38.02 64.42 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 122.575 0.35 . . . . 0.0 110.415 -179.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -68.14 -12.4 60.84 Favored 'General case' 0 CA--C 1.538 0.518 0 N-CA-C 112.172 0.434 . . . . 0.0 112.172 -177.432 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -94.67 -52.31 4.34 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 118.343 0.52 . . . . 0.0 109.9 179.546 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 6.6 ptm180 -69.45 -35.28 75.49 Favored 'General case' 0 CA--C 1.53 0.2 0 N-CA-C 112.02 0.378 . . . . 0.0 112.02 -176.645 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 43.2 p-10 -57.59 -38.62 75.2 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 118.202 0.456 . . . . 0.0 110.162 -179.214 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.41 -43.09 91.64 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 110.32 -0.252 . . . . 0.0 110.32 -179.86 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 87.4 t -60.51 -59.66 3.81 Favored 'Isoleucine or valine' 0 C--N 1.339 0.15 0 N-CA-C 110.105 -0.332 . . . . 0.0 110.105 -179.466 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 52.5 m95 -60.47 -37.28 80.52 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 116.718 -0.219 . . . . 0.0 110.942 -177.549 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -63.49 -58.2 7.77 Favored 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 178.895 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -52.39 -45.17 65.71 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 122.304 0.242 . . . . 0.0 110.766 -178.745 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 36.1 mt -54.7 -30.13 21.98 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 C-N-CA 122.245 0.218 . . . . 0.0 111.041 -179.437 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 7.7 mtpm? -85.11 -53.61 5.16 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 110.047 -0.353 . . . . 0.0 110.047 -178.676 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -63.98 -55.86 19.32 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.657 -175.425 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -73.87 -3.23 27.56 Favored 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 179.556 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 37.0 p-80 40.62 84.18 0.02 OUTLIER 'General case' 0 C--N 1.353 0.741 0 C-N-CA 124.036 0.934 . . . . 0.0 111.556 179.291 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 13.3 t80 . . . . . 0 N--CA 1.456 -0.154 0 CA-C-N 115.527 -0.76 . . . . 0.0 109.166 178.963 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 19.5 tt . . . . . 0 N--CA 1.462 0.174 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 26.7 mmtp -67.35 -62.96 1.17 Allowed 'General case' 0 N--CA 1.445 -0.69 0 C-N-CA 122.785 0.434 . . . . 0.0 110.962 -179.425 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 65.7 m-20 -69.04 -42.83 75.82 Favored 'General case' 0 N--CA 1.461 0.105 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.798 -175.764 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 18.7 m -53.31 -56.6 7.55 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.191 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 -179.905 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -59.12 -45.88 89.78 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 122.988 0.515 . . . . 0.0 110.857 179.419 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 2.0 ttmp? -53.57 -49.74 67.05 Favored 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 110.178 -0.305 . . . . 0.0 110.178 -179.101 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 57.6 ttt85 -71.67 -37.81 70.72 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 122.371 0.268 . . . . 0.0 110.645 -179.007 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -60.53 -40.17 90.55 Favored 'General case' 0 N--CA 1.456 -0.168 0 C-N-CA 122.257 0.223 . . . . 0.0 110.793 -178.595 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 23.8 t-20 -140.79 -88.36 0.17 Allowed 'General case' 0 C--N 1.343 0.325 0 N-CA-C 110.461 -0.2 . . . . 0.0 110.461 -179.418 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 71.5 t -139.47 -57.35 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.345 0.38 0 N-CA-C 109.835 -0.432 . . . . 0.0 109.835 -178.266 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 67.1 m -152.44 176.34 11.77 Favored 'General case' 0 C--N 1.344 0.339 0 N-CA-C 109.872 -0.418 . . . . 0.0 109.872 -179.342 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 17.2 p -63.52 -20.59 65.74 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.103 -179.637 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 14.9 t -53.79 -38.82 64.89 Favored 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 109.999 -0.371 . . . . 0.0 109.999 179.601 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 18.0 m -61.47 -42.47 98.83 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 109.819 -0.438 . . . . 0.0 109.819 179.463 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 20.6 t -65.72 -35.63 75.65 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.14 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 179.356 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 23.1 t -65.28 -43.59 90.69 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 72.7 m-70 -64.16 -43.22 95.85 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.285 179.38 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 16.2 t -55.72 -47.17 79.58 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.28 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 179.123 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 60.3 mt -61.63 -48.46 88.66 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 29.4 m-80 -75.28 -9.97 59.04 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 122.167 0.187 . . . . 0.0 111.119 -179.245 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 4.8 tmtp? 62.38 42.97 8.51 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 122.893 0.477 . . . . 0.0 110.012 -179.881 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -98.24 -84.4 0.39 Allowed 'General case' 0 C--N 1.344 0.357 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 179.762 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 67.1 mtp180 -97.11 120.5 37.58 Favored 'General case' 0 N--CA 1.456 -0.126 0 N-CA-C 109.496 -0.557 . . . . 0.0 109.496 -179.792 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 29.2 p90 -149.77 120.78 7.7 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 179.234 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 3.8 t -81.76 75.97 0.96 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.396 0 N-CA-C 107.856 -1.164 . . . . 0.0 107.856 179.048 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 65.11 -178.89 0.18 Allowed 'General case' 0 C--O 1.236 0.348 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.094 -178.352 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 -65.29 -25.1 67.49 Favored 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 110.214 -0.291 . . . . 0.0 110.214 -179.197 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -52.09 -39.13 59.31 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 122.565 0.346 . . . . 0.0 110.813 179.438 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 99.0 m -59.07 -67.41 0.37 Allowed 'General case' 0 C--N 1.343 0.287 0 N-CA-C 110.439 -0.208 . . . . 0.0 110.439 -179.581 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 9.9 ptm180 -56.5 -39.13 72.77 Favored 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 110.581 -0.155 . . . . 0.0 110.581 -177.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -59.7 -57.39 13.12 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 110.305 -0.257 . . . . 0.0 110.305 -179.443 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -59.81 -42.25 93.06 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 122.429 0.292 . . . . 0.0 110.649 -179.102 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 21.3 t -58.39 -61.13 1.5 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.2 0 C-N-CA 122.365 0.266 . . . . 0.0 110.324 -179.216 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 19.5 m95 -61.63 -38.22 86.86 Favored 'General case' 0 N--CA 1.455 -0.177 0 N-CA-C 110.687 -0.116 . . . . 0.0 110.687 -178.145 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -59.65 -51.42 69.89 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 109.863 -0.421 . . . . 0.0 109.863 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -61.38 -46.94 88.1 Favored 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 122.29 0.236 . . . . 0.0 110.64 -179.38 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 55.5 mt -58.18 -41.83 81.82 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.295 0 C-N-CA 122.229 0.211 . . . . 0.0 110.496 -179.22 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 37.6 ttmt -74.2 -38.81 63.5 Favored 'General case' 0 N--CA 1.45 -0.449 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 -178.067 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -62.66 -52.83 61.78 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-N 116.564 -0.289 . . . . 0.0 110.455 -178.153 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 10.2 mp -79.24 -18.16 53.38 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-O 119.554 -0.26 . . . . 0.0 110.47 -179.061 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 22.2 m80 76.17 137.62 0.06 Allowed 'General case' 0 C--N 1.348 0.509 0 C-N-CA 123.871 0.868 . . . . 0.0 110.966 178.299 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 8.1 t80 . . . . . 0 CA--C 1.529 0.158 0 N-CA-C 108.466 -0.939 . . . . 0.0 108.466 178.729 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 7.1 tt . . . . . 0 CA--C 1.547 0.85 0 N-CA-C 111.836 0.31 . . . . 0.0 111.836 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 15.6 tppt? -48.01 -70.26 0.1 Allowed 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 123.552 0.741 . . . . 0.0 112.293 -178.11 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 69.1 m-20 -63.07 -40.19 96.95 Favored 'General case' 0 C--O 1.221 -0.399 0 CA-C-O 119.787 -0.149 . . . . 0.0 110.711 -175.579 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.4 t -52.17 -46.35 43.86 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.175 0 C-N-CA 122.166 0.187 . . . . 0.0 110.785 -179.111 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -52.61 -61.36 2.33 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 110.584 -0.154 . . . . 0.0 110.584 -178.578 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -68.38 -28.21 66.91 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-O 119.791 -0.147 . . . . 0.0 111.347 -177.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 1.6 tpm_? -62.01 -48.0 82.23 Favored 'General case' 0 C--N 1.339 0.146 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 179.212 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -78.49 -1.07 32.01 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 110.068 -0.345 . . . . 0.0 110.068 178.033 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 7.7 t-20 61.13 48.06 6.67 Favored 'General case' 0 C--N 1.348 0.501 0 C-N-CA 123.613 0.765 . . . . 0.0 110.828 178.8 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 30.3 m -146.43 148.01 17.45 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.221 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 177.671 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 69.2 m -63.91 154.76 32.85 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 109.762 -0.459 . . . . 0.0 109.762 179.604 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 15.0 t -53.81 -32.72 53.76 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 116.576 -0.283 . . . . 0.0 110.364 179.484 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 3.7 m -57.07 -43.0 81.66 Favored 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 178.891 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 6.1 m -63.06 -40.79 98.72 Favored 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 179.527 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 47.1 t -64.05 -39.05 84.07 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.238 0 N-CA-C 109.333 -0.618 . . . . 0.0 109.333 179.417 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 10.0 t -55.99 -37.64 69.38 Favored 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 110.129 -0.323 . . . . 0.0 110.129 179.337 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 43.0 m170 -61.27 -33.61 73.83 Favored 'General case' 0 C--N 1.341 0.237 0 N-CA-C 110.261 -0.274 . . . . 0.0 110.261 179.704 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 90.8 t -74.56 -41.41 48.8 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.099 0 C-N-CA 122.182 0.193 . . . . 0.0 110.886 -178.969 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 72.4 mt -49.23 -55.05 4.52 Favored 'Isoleucine or valine' 0 C--N 1.343 0.298 0 C-N-CA 122.297 0.239 . . . . 0.0 110.958 -176.828 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 5.8 p30 -104.8 13.31 31.51 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 117.558 0.163 . . . . 0.0 110.825 -178.36 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 65.1 mttt 46.9 58.57 4.63 Favored 'General case' 0 C--N 1.346 0.421 0 C-N-CA 122.829 0.452 . . . . 0.0 110.64 179.268 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -72.49 -65.98 0.72 Allowed 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 -179.528 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 84.1 mtt85 -94.04 129.06 40.7 Favored 'General case' 0 C--N 1.342 0.274 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 -179.608 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -77.14 111.12 12.41 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 109.37 -0.604 . . . . 0.0 109.37 179.942 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 9.5 m -110.03 43.31 0.27 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 CA-C-N 115.806 -0.633 . . . . 0.0 109.479 -178.881 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.457 ' C ' ' H ' ' A' ' 31' ' ' GLU . . . 54.79 22.69 4.34 Favored 'General case' 0 C--N 1.345 0.379 0 C-N-CA 123.565 0.746 . . . . 0.0 112.16 178.52 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 70.6 mm-40 65.82 -26.65 0.1 Allowed 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 124.052 0.941 . . . . 0.0 113.096 178.661 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.457 ' H ' ' C ' ' A' ' 29' ' ' ALA . 40.8 tt0 -48.11 -58.93 3.82 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 118.547 0.612 . . . . 0.0 110.879 -178.528 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 7.9 m -64.64 -39.63 94.03 Favored 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 110.744 -0.095 . . . . 0.0 110.744 -178.512 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 92.2 mtt180 -57.97 -52.89 63.63 Favored 'General case' 0 CA--C 1.533 0.299 0 N-CA-C 110.129 -0.323 . . . . 0.0 110.129 -179.327 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -63.72 -37.95 89.27 Favored 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 110.066 -0.346 . . . . 0.0 110.066 -179.232 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -60.63 -42.54 97.11 Favored 'General case' 0 C--N 1.341 0.205 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 179.051 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 20.6 t -65.59 -45.08 93.39 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 179.014 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 15.4 m95 -61.63 -33.75 74.47 Favored 'General case' 0 CA--C 1.531 0.244 0 N-CA-C 109.895 -0.409 . . . . 0.0 109.895 179.145 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -67.58 -42.96 81.7 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 109.033 -0.728 . . . . 0.0 109.033 177.365 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.64 -38.67 78.61 Favored 'General case' 0 C--N 1.345 0.393 0 N-CA-C 110.001 -0.37 . . . . 0.0 110.001 178.884 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -54.65 -44.88 71.65 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 179.367 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 15.0 mttm -94.99 12.55 28.05 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-O 119.655 -0.212 . . . . 0.0 111.313 -178.467 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -79.32 -48.86 13.36 Favored 'General case' 0 N--CA 1.456 -0.168 0 N-CA-C 108.647 -0.872 . . . . 0.0 108.647 178.917 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -92.99 -94.03 0.15 Allowed 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 178.709 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 99.7 m-70 -159.79 26.41 0.18 Allowed 'General case' 0 C--N 1.343 0.286 0 C-N-CA 123.232 0.613 . . . . 0.0 109.533 -178.322 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 . . . . . 0 C--N 1.332 -0.186 0 CA-C-O 120.989 0.423 . . . . 0.0 110.036 -177.931 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.468 0.465 0 N-CA-C 110.429 -0.212 . . . . 0.0 110.429 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -66.97 -66.03 0.61 Allowed 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 122.568 0.347 . . . . 0.0 110.252 -179.812 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 91.3 m-20 -65.55 -39.0 91.23 Favored 'General case' 0 C--O 1.227 -0.084 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 84.7 t -55.52 -44.25 75.57 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.235 0 C-N-CA 122.673 0.389 . . . . 0.0 110.176 -179.487 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -57.6 -47.07 83.16 Favored 'General case' 0 C--N 1.34 0.187 0 C-N-CA 122.044 0.137 . . . . 0.0 110.707 -179.294 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 6.3 mmmm -67.09 -41.12 86.84 Favored 'General case' 0 N--CA 1.457 -0.089 0 N-CA-C 109.773 -0.454 . . . . 0.0 109.773 179.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 45.0 ttt85 -59.52 -35.79 74.86 Favored 'General case' 0 N--CA 1.452 -0.351 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 179.131 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -75.89 -56.93 4.2 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 110.029 -0.359 . . . . 0.0 110.029 179.556 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -164.15 -93.73 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 119.82 -0.133 . . . . 0.0 111.276 -179.151 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 5.0 m -97.94 -118.63 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 C-N-CA 122.232 0.213 . . . . 0.0 110.867 -176.248 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 89.5 p -105.98 -175.09 2.7 Favored 'General case' 0 C--N 1.344 0.36 0 C-N-CA 122.621 0.368 . . . . 0.0 110.327 -176.981 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 76.8 p -55.83 -23.83 32.81 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.215 -178.398 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 13.2 t -51.62 -44.83 63.05 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 117.724 0.238 . . . . 0.0 110.426 -179.898 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 2.4 m -64.92 -47.91 76.04 Favored 'General case' 0 C--N 1.341 0.219 0 N-CA-C 110.301 -0.259 . . . . 0.0 110.301 -179.453 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 54.6 t -58.4 -44.84 89.52 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.169 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 -179.47 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 56.3 m -60.91 -45.81 93.18 Favored 'General case' 0 C--O 1.22 -0.496 0 N-CA-C 110.013 -0.365 . . . . 0.0 110.013 179.489 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 34.7 m170 -58.31 -41.58 84.78 Favored 'General case' 0 C--N 1.339 0.148 0 N-CA-C 110.292 -0.262 . . . . 0.0 110.292 -179.608 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 42.4 t -65.88 -55.93 17.17 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.257 0 O-C-N 123.085 0.241 . . . . 0.0 110.688 -178.939 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 92.6 mt -64.02 -53.34 45.12 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 N-CA-C 110.299 -0.26 . . . . 0.0 110.299 -177.69 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 19.4 t-20 -62.32 -30.66 71.31 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 122.624 0.37 . . . . 0.0 110.581 -179.237 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 41.2 tttp 71.45 53.09 0.23 Allowed 'General case' 0 C--N 1.344 0.342 0 C-N-CA 122.915 0.486 . . . . 0.0 109.735 179.816 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 26.6 p -75.71 -64.57 1.05 Allowed 'General case' 0 C--N 1.34 0.154 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 179.39 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 48.6 ttp85 -128.89 134.23 48.2 Favored 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 179.629 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 54.6 p90 -64.85 143.19 58.11 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 179.749 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 30.1 m -110.27 170.42 3.28 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.147 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 179.529 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -80.3 51.35 1.4 Allowed 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 122.402 0.281 . . . . 0.0 111.213 -177.728 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 63.79 -68.68 0.09 Allowed 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.249 1.02 . . . . 0.0 112.746 177.835 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 56.5 mm-40 -37.4 -53.5 1.12 Allowed 'General case' 0 C--N 1.34 0.162 0 C-N-CA 123.729 0.812 . . . . 0.0 112.076 -175.042 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 8.2 m -60.05 -52.04 67.07 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 116.983 -0.098 . . . . 0.0 111.015 -177.47 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 11.8 ttp85 -60.89 -47.47 86.24 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 122.26 0.224 . . . . 0.0 110.64 -178.58 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 20.5 m-80 -61.69 -41.18 97.22 Favored 'General case' 0 N--CA 1.456 -0.158 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 -179.788 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -60.79 -40.62 93.3 Favored 'General case' 0 C--N 1.34 0.185 0 N-CA-C 110.158 -0.312 . . . . 0.0 110.158 179.852 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 38.0 t -64.09 -53.79 39.39 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.199 0 N-CA-C 109.6 -0.518 . . . . 0.0 109.6 179.439 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 13.5 m95 -59.82 -33.92 72.39 Favored 'General case' 0 C--O 1.233 0.229 0 N-CA-C 110.615 -0.143 . . . . 0.0 110.615 -179.202 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -70.37 -57.85 4.38 Favored 'General case' 0 C--O 1.224 -0.286 0 N-CA-C 109.789 -0.449 . . . . 0.0 109.789 179.401 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -50.09 -44.19 51.81 Favored 'General case' 0 C--N 1.341 0.203 0 C-N-CA 122.94 0.496 . . . . 0.0 111.066 -179.082 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 13.8 mt -51.36 -40.92 24.62 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 C-N-CA 122.977 0.511 . . . . 0.0 111.046 -179.36 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 41.2 mttp -98.03 -20.0 17.66 Favored 'General case' 0 C--N 1.344 0.328 0 N-CA-C 111.567 0.21 . . . . 0.0 111.567 -177.13 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -73.17 -50.04 24.8 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 109.106 -0.702 . . . . 0.0 109.106 -178.089 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 51.6 tp -77.64 -92.0 0.03 OUTLIER 'General case' 0 N--CA 1.446 -0.642 0 N-CA-C 108.153 -1.054 . . . . 0.0 108.153 177.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 4.0 p-80 165.3 75.87 0.0 OUTLIER 'General case' 0 C--N 1.341 0.233 0 C-N-CA 123.759 0.824 . . . . 0.0 108.996 179.781 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 15.6 t80 . . . . . 0 C--N 1.325 -0.486 0 CA-C-N 116.118 -0.492 . . . . 0.0 109.776 -179.411 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.47 0.528 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 62.9 mttp -69.68 -60.97 1.98 Allowed 'General case' 0 N--CA 1.446 -0.64 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 177.586 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -63.91 -51.49 64.25 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 115.683 -0.69 . . . . 0.0 109.502 178.619 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 76.5 t -45.65 -47.1 4.79 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.225 0 C-N-CA 123.121 0.569 . . . . 0.0 111.707 -177.399 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -53.86 -62.46 1.64 Allowed 'General case' 0 C--O 1.223 -0.313 0 CA-C-N 117.511 0.142 . . . . 0.0 111.333 -177.78 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 21.7 mmmt -68.45 -44.11 75.6 Favored 'General case' 0 C--N 1.331 -0.232 0 O-C-N 122.45 -0.156 . . . . 0.0 110.988 -176.874 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 16.3 tpp180 -57.82 -39.82 78.52 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 122.568 0.347 . . . . 0.0 110.7 -178.467 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -98.22 12.86 33.26 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-O 119.562 -0.256 . . . . 0.0 110.825 -179.384 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . 0.495 ' O ' ' CG2' ' A' ' 13' ' ' VAL . 48.6 t30 75.52 150.83 0.12 Allowed 'General case' 0 C--N 1.35 0.589 0 C-N-CA 123.684 0.793 . . . . 0.0 110.147 179.945 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.495 ' CG2' ' O ' ' A' ' 12' ' ' ASN . 2.2 m 82.94 175.1 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.479 0.982 0 C-N-CA 125.679 1.591 . . . . 0.0 110.315 -179.609 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 22.4 t -96.91 -178.06 4.09 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.501 -177.623 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 19.1 p -69.0 -45.17 71.25 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.383 -179.048 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 11.9 t -56.22 -41.93 76.45 Favored 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 110.46 -0.2 . . . . 0.0 110.46 -179.121 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -65.3 -28.28 69.21 Favored 'General case' 0 CA--C 1.53 0.202 0 O-C-N 122.24 -0.287 . . . . 0.0 110.34 179.893 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 65.8 t -76.59 -37.89 30.21 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.199 0 N-CA-C 108.496 -0.927 . . . . 0.0 108.496 176.707 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 19.6 m -58.71 -33.08 69.79 Favored 'General case' 0 CA--C 1.531 0.226 0 N-CA-C 109.989 -0.374 . . . . 0.0 109.989 178.521 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 51.4 m170 -56.13 -39.35 72.1 Favored 'General case' 0 C--N 1.345 0.381 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 178.398 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 56.4 t -68.02 -46.36 81.87 Favored 'Isoleucine or valine' 0 C--N 1.341 0.211 0 N-CA-C 109.786 -0.45 . . . . 0.0 109.786 179.66 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 72.7 mt -58.87 -39.57 77.82 Favored 'Isoleucine or valine' 0 C--O 1.234 0.253 0 N-CA-C 109.835 -0.431 . . . . 0.0 109.835 -179.236 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 34.5 m-80 -93.77 15.35 16.67 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 122.369 0.267 . . . . 0.0 110.282 179.436 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 30.15 65.39 0.14 Allowed 'General case' 0 C--N 1.356 0.868 0 C-N-CA 124.376 1.07 . . . . 0.0 111.566 -179.357 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 17.4 p -104.44 -83.7 0.49 Allowed 'General case' 0 C--N 1.342 0.24 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 178.208 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 14.4 tpt180 -90.81 105.29 17.72 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 108.936 -0.764 . . . . 0.0 108.936 179.212 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 40.7 t80 -78.26 100.45 6.69 Favored 'General case' 0 N--CA 1.454 -0.227 0 N-CA-C 109.705 -0.48 . . . . 0.0 109.705 -179.738 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 4.3 t -87.28 57.4 0.17 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.42 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 -179.917 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 65.26 176.25 0.21 Allowed 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 123.233 0.613 . . . . 0.0 111.489 178.933 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 48.1 mp0 -68.9 -25.74 64.75 Favored 'General case' 0 C--O 1.219 -0.509 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.009 -179.273 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 20.6 tp10 -53.81 -60.26 3.55 Favored 'General case' 0 C--O 1.226 -0.165 0 C-N-CA 122.559 0.344 . . . . 0.0 111.263 -176.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 63.1 p -61.83 -44.75 96.21 Favored 'General case' 0 C--O 1.224 -0.272 0 N-CA-C 110.003 -0.369 . . . . 0.0 110.003 -178.555 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 64.7 ttp85 -56.37 -60.19 3.87 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 122.41 0.284 . . . . 0.0 111.284 -178.192 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -67.01 -39.91 87.17 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-O 119.603 -0.236 . . . . 0.0 111.08 -175.231 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -62.8 -45.13 94.06 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 117.881 0.309 . . . . 0.0 110.409 -179.777 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 20.3 t -60.63 -57.25 12.82 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.108 0 C-N-CA 122.299 0.24 . . . . 0.0 110.646 -178.802 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 14.9 m95 -60.14 -38.04 81.89 Favored 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 110.77 -0.085 . . . . 0.0 110.77 -178.151 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -63.25 -53.23 56.28 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 -179.933 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -60.3 -40.49 90.72 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-N 116.569 -0.287 . . . . 0.0 110.636 -179.139 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 14.3 mt -59.53 -44.53 93.27 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.146 0 N-CA-C 110.232 -0.284 . . . . 0.0 110.232 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 57.8 tptt -70.27 -35.28 73.65 Favored 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 -178.59 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -66.74 -52.87 39.27 Favored 'General case' 0 N--CA 1.443 -0.798 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.041 -177.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 10.5 mp -81.78 -21.05 38.0 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 122.348 0.259 . . . . 0.0 111.305 -177.456 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 2.4 m-70 71.73 110.66 0.06 Allowed 'General case' 0 N--CA 1.465 0.317 0 N-CA-C 108.636 -0.876 . . . . 0.0 108.636 -177.032 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 1.3 t80 . . . . . 0 C--N 1.325 -0.474 0 C-N-CA 122.83 0.452 . . . . 0.0 110.387 -176.522 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 14.8 tt . . . . . 0 N--CA 1.465 0.317 0 N-CA-C 109.802 -0.444 . . . . 0.0 109.802 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 22.3 mtmm -48.33 -68.55 0.17 Allowed 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 123.657 0.783 . . . . 0.0 111.849 -177.587 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -52.23 -58.46 6.57 Favored 'General case' 0 C--O 1.219 -0.504 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.073 -177.667 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 63.1 t -50.22 -42.4 20.17 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.398 0 O-C-N 123.001 0.188 . . . . 0.0 111.197 -176.434 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -53.38 -62.86 1.38 Allowed 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 112.019 0.377 . . . . 0.0 112.019 -177.024 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 19.0 mtpp -79.1 -38.33 36.47 Favored 'General case' 0 N--CA 1.461 0.12 0 N-CA-C 110.618 -0.142 . . . . 0.0 110.618 -176.088 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 57.5 ttm-85 -57.6 -35.26 70.2 Favored 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 179.197 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -76.36 -60.82 2.17 Favored 'General case' 0 C--N 1.347 0.463 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 177.288 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 179.99 131.0 0.1 Allowed 'General case' 0 C--N 1.347 0.461 0 CA-C-O 120.686 0.279 . . . . 0.0 111.295 179.641 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 37.8 t 52.18 -94.52 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 C-N-CA 123.788 0.835 . . . . 0.0 111.497 176.31 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 66.9 m -149.96 -178.31 6.41 Favored 'General case' 0 C--N 1.344 0.364 0 CA-C-O 120.777 0.322 . . . . 0.0 110.368 -177.479 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 10.0 m -53.2 -35.26 59.68 Favored 'General case' 0 C--O 1.224 -0.259 0 C-N-CA 123.161 0.585 . . . . 0.0 110.975 -178.803 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 17.1 p -51.71 -46.86 64.1 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 122.46 0.304 . . . . 0.0 110.425 -179.29 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 24.9 m -65.62 -48.42 72.3 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 110.327 -0.249 . . . . 0.0 110.327 -178.907 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 87.5 t -60.38 -35.1 60.46 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.35 0 N-CA-C 110.242 -0.281 . . . . 0.0 110.242 -179.439 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 7.7 t -59.48 -45.06 92.72 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 109.983 -0.377 . . . . 0.0 109.983 -179.609 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 80.6 m-70 -58.49 -40.11 81.87 Favored 'General case' 0 N--CA 1.456 -0.135 0 O-C-N 122.996 0.185 . . . . 0.0 110.695 -179.021 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 52.9 t -56.27 -52.7 48.44 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.153 0 N-CA-C 110.003 -0.369 . . . . 0.0 110.003 -179.599 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 78.4 mt -66.04 -42.5 91.7 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 -179.415 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 37.8 t-20 -66.02 -20.92 66.34 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 122.973 0.509 . . . . 0.0 110.608 -179.545 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 74.3 tttt 66.24 50.98 1.29 Allowed 'General case' 0 C--N 1.343 0.289 0 C-N-CA 122.952 0.501 . . . . 0.0 109.655 -179.607 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -97.95 -82.89 0.41 Allowed 'General case' 0 C--N 1.341 0.212 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 179.665 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 19.0 ptp180 -87.36 154.17 20.89 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 179.792 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 50.5 t80 -123.83 145.39 49.11 Favored 'General case' 0 N--CA 1.456 -0.151 0 N-CA-C 109.886 -0.413 . . . . 0.0 109.886 -179.729 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 2.9 t -134.97 172.87 15.35 Favored 'Isoleucine or valine' 0 C--O 1.231 0.114 0 N-CA-C 107.828 -1.175 . . . . 0.0 107.828 179.198 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -48.08 149.52 1.41 Allowed 'General case' 0 C--O 1.235 0.331 0 N-CA-C 110.142 -0.318 . . . . 0.0 110.142 179.051 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 22.2 mp0 -51.3 -28.37 11.89 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.681 -179.225 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -57.02 -47.91 79.74 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 122.216 0.206 . . . . 0.0 110.499 179.624 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 10.4 m -64.82 -49.7 69.58 Favored 'General case' 0 C--N 1.344 0.359 0 N-CA-C 110.189 -0.3 . . . . 0.0 110.189 -178.74 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 38.4 mmt-85 -55.84 -50.64 70.0 Favored 'General case' 0 N--CA 1.455 -0.206 0 N-CA-C 109.785 -0.45 . . . . 0.0 109.785 -179.557 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -59.0 -48.49 81.38 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 122.552 0.341 . . . . 0.0 110.379 -179.613 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -57.83 -45.2 86.53 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 122.121 0.168 . . . . 0.0 110.678 -178.934 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 54.6 t -60.28 -57.24 12.73 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 N-CA-C 110.243 -0.28 . . . . 0.0 110.243 -178.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 41.4 m95 -60.63 -40.26 91.25 Favored 'General case' 0 CA--C 1.53 0.183 0 N-CA-C 110.735 -0.098 . . . . 0.0 110.735 -178.434 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -60.29 -53.14 61.24 Favored 'General case' 0 N--CA 1.453 -0.278 0 N-CA-C 109.722 -0.473 . . . . 0.0 109.722 179.69 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -56.41 -45.19 80.79 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 122.316 0.246 . . . . 0.0 110.493 -179.632 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 31.1 mt -56.18 -36.9 47.34 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.472 0 C-N-CA 122.256 0.223 . . . . 0.0 110.694 -179.314 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 6.3 mptp? -80.23 -45.6 17.71 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 -178.587 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 24.1 mm-40 -58.29 -47.4 83.78 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 122.48 0.312 . . . . 0.0 110.964 -178.052 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 6.0 mp -80.67 -1.8 44.01 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-O 119.611 -0.233 . . . . 0.0 110.777 -178.691 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 4.7 m-70 60.05 32.0 20.84 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 122.873 0.469 . . . . 0.0 110.905 178.454 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 10.2 t80 . . . . . 0 C--N 1.33 -0.243 0 N-CA-C 109.438 -0.579 . . . . 0.0 109.438 179.237 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 19.8 tt . . . . . 0 C--O 1.225 -0.204 0 N-CA-C 110.149 -0.315 . . . . 0.0 110.149 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 45.0 mtpt -57.01 -60.14 4.03 Favored 'General case' 0 N--CA 1.446 -0.625 0 C-N-CA 122.699 0.399 . . . . 0.0 110.475 179.059 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -70.19 -42.64 72.12 Favored 'General case' 0 N--CA 1.458 -0.068 0 N-CA-C 110.168 -0.308 . . . . 0.0 110.168 -177.683 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 54.8 t -55.01 -47.74 76.58 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.166 0 N-CA-C 110.188 -0.301 . . . . 0.0 110.188 -179.408 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -58.16 -54.98 40.86 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 122.349 0.26 . . . . 0.0 110.864 -178.455 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 27.0 tttt -65.79 -27.39 68.24 Favored 'General case' 0 CA--C 1.531 0.247 0 O-C-N 122.808 0.068 . . . . 0.0 110.908 -177.931 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.95 -36.22 69.82 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 177.759 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -78.19 -41.59 34.1 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.264 -178.427 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -155.12 -147.67 0.21 Allowed 'General case' 0 N--CA 1.449 -0.504 0 CA-C-O 120.841 0.353 . . . . 0.0 110.727 -177.321 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 62.0 t -71.44 -54.39 17.43 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.501 0 C-N-CA 123.012 0.525 . . . . 0.0 110.336 -178.804 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 50.8 m -155.49 -179.05 7.73 Favored 'General case' 0 C--N 1.346 0.42 0 CA-C-O 121.007 0.432 . . . . 0.0 110.806 -177.806 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.8 m -66.98 -3.26 6.67 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.158 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 16.6 p -57.83 -56.09 26.48 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 179.132 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -60.29 -33.86 72.95 Favored 'General case' 0 CA--C 1.537 0.442 0 N-CA-C 110.265 -0.272 . . . . 0.0 110.265 -179.268 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 58.1 t -64.51 -46.74 91.82 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.222 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 179.269 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 20.6 m -60.26 -43.28 96.28 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 178.753 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 48.5 m170 -58.19 -43.3 87.48 Favored 'General case' 0 C--O 1.221 -0.414 0 N-CA-C 109.867 -0.419 . . . . 0.0 109.867 179.357 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 7.3 t -68.2 -39.61 81.46 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 C-N-CA 122.351 0.26 . . . . 0.0 111.155 -179.045 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 40.3 mt -60.04 -59.14 4.48 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.395 0 CA-C-O 119.424 -0.322 . . . . 0.0 111.789 -176.521 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 2.4 p-10 -114.14 22.12 14.13 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-N 118.235 0.47 . . . . 0.0 112.1 -175.644 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 29.6 ttpt 55.22 46.04 24.58 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 122.313 0.245 . . . . 0.0 110.774 177.96 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -66.93 -35.33 79.75 Favored 'General case' 0 C--N 1.341 0.203 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 179.088 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 9.7 tpt180 -142.08 143.08 32.9 Favored 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 -179.89 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 63.8 t80 -68.03 137.11 54.8 Favored 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 -179.903 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 10.5 m -141.49 153.76 19.81 Favored 'Isoleucine or valine' 0 C--O 1.236 0.375 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 178.592 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -66.11 159.43 26.18 Favored 'General case' 0 N--CA 1.45 -0.438 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 179.273 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -52.18 -41.82 62.96 Favored 'General case' 0 CA--C 1.529 0.135 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 179.641 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 51.2 mt-10 -52.19 -47.37 65.59 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 123.039 0.536 . . . . 0.0 111.075 -179.165 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -61.05 -46.96 88.57 Favored 'General case' 0 C--N 1.341 0.208 0 N-CA-C 110.104 -0.332 . . . . 0.0 110.104 -178.704 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 27.6 ttm105 -58.43 -53.68 55.62 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.338 -178.875 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 29.2 m120 -60.68 -46.1 91.62 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 116.676 -0.238 . . . . 0.0 110.54 -179.275 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -56.63 -47.92 78.66 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 122.428 0.291 . . . . 0.0 110.782 -178.555 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 24.5 t -58.92 -56.64 15.55 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.196 0 N-CA-C 110.319 -0.252 . . . . 0.0 110.319 -179.108 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 20.6 m95 -59.91 -36.39 76.89 Favored 'General case' 0 C--N 1.341 0.201 0 O-C-N 122.568 -0.083 . . . . 0.0 110.888 -178.537 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -65.42 -51.65 58.8 Favored 'General case' 0 N--CA 1.456 -0.172 0 N-CA-C 110.051 -0.352 . . . . 0.0 110.051 179.894 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -57.51 -43.13 83.97 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 122.615 0.366 . . . . 0.0 110.776 -179.026 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 33.0 mt -56.85 -42.67 78.53 Favored 'Isoleucine or valine' 0 C--N 1.34 0.196 0 C-N-CA 122.205 0.202 . . . . 0.0 110.496 -179.447 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 37.0 mtmm -76.82 -36.49 56.87 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 110.024 -0.361 . . . . 0.0 110.024 -179.168 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -60.89 -60.95 2.98 Favored 'General case' 0 N--CA 1.451 -0.402 0 O-C-N 123.259 0.35 . . . . 0.0 110.924 -178.27 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -81.09 -18.69 45.68 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-O 119.624 -0.227 . . . . 0.0 111.268 -177.5 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 5.1 m-70 76.18 128.48 0.04 OUTLIER 'General case' 0 C--N 1.344 0.346 0 C-N-CA 123.411 0.685 . . . . 0.0 109.701 -178.567 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 6.7 t80 . . . . . 0 C--O 1.218 -0.592 0 N-CA-C 108.404 -0.961 . . . . 0.0 108.404 178.168 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.43 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 11.4 tt . . . . . 0 N--CA 1.472 0.668 0 N-CA-C 108.26 -1.015 . . . . 0.0 108.26 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 67.0 mttm -61.11 -62.71 1.65 Allowed 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 123.428 0.691 . . . . 0.0 110.956 -178.114 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -51.94 -48.45 64.27 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.315 -178.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 10.9 t -65.01 -38.63 83.29 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.363 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.73 -177.705 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.25 -38.76 90.5 Favored 'General case' 0 CA--C 1.531 0.213 0 N-CA-C 110.414 -0.217 . . . . 0.0 110.414 -179.627 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 64.8 mmtt -73.47 -35.52 65.72 Favored 'General case' 0 CA--C 1.53 0.19 0 N-CA-C 110.121 -0.326 . . . . 0.0 110.121 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.59 -40.41 80.48 Favored 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 178.145 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -70.54 -48.55 54.9 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 123.024 0.53 . . . . 0.0 111.096 -178.585 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 4.6 t-20 -156.28 -137.16 0.06 Allowed 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 110.494 -0.187 . . . . 0.0 110.494 -178.017 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 87.4 t -92.5 -43.01 13.68 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.141 0 C-N-CA 122.873 0.469 . . . . 0.0 110.38 -177.668 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 27.0 t -152.46 167.44 28.75 Favored 'General case' 0 N--CA 1.453 -0.325 0 N-CA-C 110.068 -0.345 . . . . 0.0 110.068 -178.83 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 14.8 t -60.84 -27.75 68.31 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.201 -179.877 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 6.3 m -53.3 -54.14 40.71 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 122.555 0.342 . . . . 0.0 110.223 179.936 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 7.2 m -61.21 -45.45 94.51 Favored 'General case' 0 C--N 1.34 0.177 0 N-CA-C 110.25 -0.278 . . . . 0.0 110.25 -179.321 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 93.4 t -59.4 -38.1 73.18 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.231 0 N-CA-C 109.884 -0.413 . . . . 0.0 109.884 -179.7 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 21.0 t -65.87 -48.31 72.0 Favored 'General case' 0 N--CA 1.449 -0.495 0 N-CA-C 109.314 -0.625 . . . . 0.0 109.314 -179.611 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 59.4 m-70 -52.84 -47.27 67.84 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 110.572 -0.158 . . . . 0.0 110.572 -179.439 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 47.2 t -53.18 -49.95 48.82 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 N-CA-C 109.797 -0.446 . . . . 0.0 109.797 179.767 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 58.1 mt -64.63 -39.07 84.36 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 N-CA-C 110.1 -0.333 . . . . 0.0 110.1 -179.62 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 13.2 m120 -77.51 -4.99 48.44 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 122.22 0.208 . . . . 0.0 110.869 -179.476 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 93.4 mttt 57.33 49.95 12.32 Favored 'General case' 0 C--N 1.344 0.365 0 C-N-CA 122.917 0.487 . . . . 0.0 110.071 -179.701 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 1.1 p -109.63 -79.98 0.58 Allowed 'General case' 0 C--N 1.343 0.285 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 179.752 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 51.2 ttm-85 -72.1 96.6 1.79 Allowed 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 109.168 -0.678 . . . . 0.0 109.168 179.843 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 32.7 t80 -74.91 98.32 3.53 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 109.866 -0.42 . . . . 0.0 109.866 -179.157 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -85.15 177.55 0.59 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.373 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 178.712 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.5 159.38 29.78 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 178.326 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -57.25 -35.37 69.64 Favored 'General case' 0 N--CA 1.455 -0.214 0 N-CA-C 109.935 -0.394 . . . . 0.0 109.935 179.676 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 51.6 mt-10 -58.89 -51.57 69.46 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 122.355 0.262 . . . . 0.0 110.324 179.876 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.56 -43.02 81.66 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 110.067 -0.346 . . . . 0.0 110.067 -178.748 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 29.7 ttm105 -56.42 -51.25 69.07 Favored 'General case' 0 N--CA 1.454 -0.271 0 N-CA-C 110.055 -0.35 . . . . 0.0 110.055 179.902 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 88.7 m-20 -63.11 -45.3 92.66 Favored 'General case' 0 N--CA 1.456 -0.161 0 N-CA-C 110.09 -0.337 . . . . 0.0 110.09 -179.88 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -56.88 -41.87 78.81 Favored 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 110.509 -0.182 . . . . 0.0 110.509 -179.612 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 36.8 t -64.07 -54.58 29.71 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 N-CA-C 109.947 -0.39 . . . . 0.0 109.947 -179.676 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 29.6 m95 -56.91 -39.89 75.26 Favored 'General case' 0 C--N 1.34 0.19 0 N-CA-C 110.466 -0.198 . . . . 0.0 110.466 -179.316 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -65.03 -56.71 11.52 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 179.622 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -50.09 -45.15 52.41 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 123.062 0.545 . . . . 0.0 111.33 -179.001 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 26.0 mt -53.29 -44.2 53.01 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.233 0 C-N-CA 122.297 0.239 . . . . 0.0 110.703 -178.882 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 39.1 ttpt -81.05 -37.35 29.19 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 122.068 0.147 . . . . 0.0 110.61 -177.557 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 70.0 mt-10 -52.19 -58.33 6.93 Favored 'General case' 0 C--N 1.342 0.259 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 -179.083 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -75.92 -46.67 28.77 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 -179.665 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 69.43 130.98 0.03 OUTLIER 'General case' 0 C--N 1.347 0.48 0 C-N-CA 123.22 0.608 . . . . 0.0 109.718 -178.988 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.43 ' CE2' ' HA ' ' A' ' 4' ' ' ILE . 5.1 p90 . . . . . 0 CA--C 1.537 0.446 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 179.398 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.473 0.704 0 N-CA-C 110.253 -0.277 . . . . 0.0 110.253 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -70.78 -59.36 2.85 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 123.075 0.55 . . . . 0.0 110.39 -178.552 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -45.37 -58.56 3.23 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.721 0.808 . . . . 0.0 111.314 -178.422 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 88.3 t -61.44 -47.1 94.99 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.151 0 C-N-CA 122.57 0.348 . . . . 0.0 110.794 -177.15 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -56.74 -44.47 81.73 Favored 'General case' 0 N--CA 1.455 -0.205 0 O-C-N 122.24 -0.288 . . . . 0.0 110.299 -179.548 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 53.0 mttp -72.4 -15.61 61.84 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-O 119.187 -0.435 . . . . 0.0 111.441 -177.887 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 8.6 tpm_? -59.3 -43.87 92.57 Favored 'General case' 0 C--N 1.343 0.297 0 N-CA-C 108.034 -1.098 . . . . 0.0 108.034 177.091 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -99.15 7.08 46.15 Favored 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 176.298 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 47.5 t30 70.74 -84.9 0.03 OUTLIER 'General case' 0 C--N 1.347 0.497 0 C-N-CA 124.519 1.127 . . . . 0.0 110.163 -179.442 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 2.7 t 29.44 -125.2 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.74 0 C-N-CA 124.518 1.127 . . . . 0.0 110.564 -177.845 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.459 ' C ' ' H ' ' A' ' 16' ' ' THR . 1.5 m -175.25 84.52 0.03 OUTLIER 'General case' 0 C--N 1.347 0.487 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 179.084 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.4 p 50.7 -2.5 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 125.252 1.421 . . . . 0.0 114.697 177.591 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' THR . . . . . 0.459 ' H ' ' C ' ' A' ' 14' ' ' SER . 0.8 OUTLIER -88.68 -42.47 11.96 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 118.54 0.609 . . . . 0.0 110.669 -177.947 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 13.2 t -51.41 -42.25 61.33 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 122.334 0.253 . . . . 0.0 111.361 -177.908 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 42.4 t -60.12 -54.82 29.5 Favored 'Isoleucine or valine' 0 C--O 1.232 0.134 0 N-CA-C 109.93 -0.396 . . . . 0.0 109.93 -179.076 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 19.7 m -60.0 -42.02 93.38 Favored 'General case' 0 C--O 1.222 -0.361 0 CA-C-N 116.67 -0.241 . . . . 0.0 110.613 -179.496 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 24.3 m170 -62.58 -43.92 97.61 Favored 'General case' 0 CA--C 1.528 0.123 0 C-N-CA 122.202 0.201 . . . . 0.0 110.579 -178.455 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 9.3 t -64.56 -49.61 79.74 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.187 0 C-N-CA 122.249 0.22 . . . . 0.0 110.613 -178.616 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 89.1 mt -65.9 -51.5 60.38 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.23 0 N-CA-C 110.044 -0.354 . . . . 0.0 110.044 -178.669 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 20.4 t-20 -63.88 -31.47 72.67 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 122.649 0.38 . . . . 0.0 111.016 -178.693 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 17.7 ttmt 67.13 40.34 2.88 Favored 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 -177.822 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 12.5 t -74.68 -29.48 61.24 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.331 -179.015 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 2.0 tmt_? -157.96 125.02 5.01 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 -179.423 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 46.4 p90 -59.08 147.87 33.24 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 110.026 -0.361 . . . . 0.0 110.026 -179.878 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -106.66 -173.05 0.42 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.327 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 -179.877 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -79.18 40.93 0.43 Allowed 'General case' 0 CA--C 1.536 0.44 0 O-C-N 122.353 -0.217 . . . . 0.0 111.493 -178.06 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 63.95 -74.58 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 123.347 0.659 . . . . 0.0 111.607 178.238 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -58.88 -35.06 72.38 Favored 'General case' 0 C--N 1.341 0.207 0 C-N-CA 122.5 0.32 . . . . 0.0 110.776 -177.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 8.9 m -61.06 -40.65 94.47 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 179.205 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 19.5 ttt180 -71.03 -43.03 68.7 Favored 'General case' 0 N--CA 1.454 -0.235 0 N-CA-C 109.689 -0.486 . . . . 0.0 109.689 179.383 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 35.0 t30 -58.07 -45.02 87.81 Favored 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 109.857 -0.423 . . . . 0.0 109.857 179.217 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -58.26 -42.58 86.77 Favored 'General case' 0 N--CA 1.456 -0.174 0 C-N-CA 122.541 0.337 . . . . 0.0 110.667 -179.505 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 25.6 t -62.67 -53.52 45.95 Favored 'Isoleucine or valine' 0 C--O 1.233 0.225 0 N-CA-C 109.924 -0.398 . . . . 0.0 109.924 -179.737 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 38.8 m95 -59.11 -39.97 83.94 Favored 'General case' 0 C--N 1.339 0.144 0 N-CA-C 110.487 -0.19 . . . . 0.0 110.487 -179.828 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -63.76 -52.32 60.94 Favored 'General case' 0 C--O 1.222 -0.369 0 N-CA-C 110.175 -0.306 . . . . 0.0 110.175 -179.459 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -56.07 -39.77 72.57 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 122.386 0.274 . . . . 0.0 111.334 -178.378 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 19.8 mt -53.34 -56.56 7.75 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 C-N-CA 122.219 0.208 . . . . 0.0 111.399 -177.617 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.3 -26.56 24.86 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 117.688 0.222 . . . . 0.0 111.473 -176.536 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -71.23 -47.71 55.65 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 117.875 0.307 . . . . 0.0 110.544 -178.195 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 79.1 mt -80.08 -14.59 58.4 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-O 119.389 -0.339 . . . . 0.0 110.939 -178.38 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 88.0 m-70 53.35 45.5 28.29 Favored 'General case' 0 C--N 1.348 0.514 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 -178.989 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.547 0.827 0 CA-C-N 115.76 -0.655 . . . . 0.0 112.673 -177.295 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 19.6 tt . . . . . 0 C--O 1.221 -0.444 0 N-CA-C 109.937 -0.394 . . . . 0.0 109.937 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -60.24 -64.15 1.05 Allowed 'General case' 0 N--CA 1.441 -0.91 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.295 -177.887 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -61.27 -52.82 63.15 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 122.963 0.505 . . . . 0.0 111.368 -178.177 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 86.2 t -59.36 -42.59 87.91 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.291 0 CA-C-O 119.517 -0.278 . . . . 0.0 111.272 -176.583 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -54.93 -53.71 52.05 Favored 'General case' 0 C--N 1.341 0.23 0 CA-C-N 118.014 0.37 . . . . 0.0 110.151 -179.128 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 20.1 mmmt -60.68 -47.92 84.12 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 110.006 -0.368 . . . . 0.0 110.006 -178.509 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.49 -37.16 77.52 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 116.455 -0.338 . . . . 0.0 110.624 -178.903 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -73.58 -47.84 37.45 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 122.089 0.156 . . . . 0.0 110.649 -178.489 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 50.1 t30 -171.25 139.78 1.38 Allowed 'General case' 0 C--N 1.347 0.485 0 N-CA-C 110.204 -0.295 . . . . 0.0 110.204 -177.562 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER 23.32 -87.3 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.954 0 C-N-CA 125.162 1.385 . . . . 0.0 112.811 177.636 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 71.8 m -151.18 -172.07 4.11 Favored 'General case' 0 C--N 1.348 0.518 0 C-N-CA 122.647 0.379 . . . . 0.0 110.074 -179.32 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 21.3 p -55.31 -16.19 3.19 Favored 'General case' 0 C--N 1.345 0.401 0 C-N-CA 123.253 0.621 . . . . 0.0 111.518 -179.053 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 4.7 m -52.41 -39.97 61.58 Favored 'General case' 0 CA--C 1.534 0.362 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 177.118 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 75.4 m -69.68 -40.17 76.54 Favored 'General case' 0 C--N 1.342 0.261 0 N-CA-C 109.95 -0.389 . . . . 0.0 109.95 179.054 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 84.0 t -59.46 -37.85 72.03 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.21 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 179.858 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 15.7 m -56.06 -39.12 71.55 Favored 'General case' 0 C--N 1.341 0.196 0 N-CA-C 110.067 -0.346 . . . . 0.0 110.067 179.146 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 23.8 m170 -62.57 -29.71 70.79 Favored 'General case' 0 C--O 1.223 -0.307 0 N-CA-C 110.155 -0.313 . . . . 0.0 110.155 179.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 5.1 t -80.42 -49.37 18.82 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.141 0 C-N-CA 122.202 0.201 . . . . 0.0 110.912 -177.97 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 78.9 mt -44.81 -53.99 1.35 Allowed 'Isoleucine or valine' 0 C--N 1.341 0.238 0 C-N-CA 122.811 0.444 . . . . 0.0 111.455 -175.675 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.7 p-10 -114.43 26.74 10.0 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-O 119.861 -0.114 . . . . 0.0 110.923 -177.852 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 74.1 tttt 40.61 51.68 3.01 Favored 'General case' 0 C--N 1.346 0.437 0 C-N-CA 123.009 0.524 . . . . 0.0 110.68 179.62 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -67.12 -31.81 72.52 Favored 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 -179.811 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 59.2 ttt85 -158.1 111.86 2.49 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 179.658 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 48.8 p90 -78.53 136.71 37.63 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 109.205 -0.665 . . . . 0.0 109.205 179.425 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 57.3 t -112.44 83.74 0.69 Allowed 'Isoleucine or valine' 0 N--CA 1.457 -0.121 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 179.703 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 59.44 13.4 3.21 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 115.683 -0.689 . . . . 0.0 111.535 -179.335 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 71.17 -55.93 0.64 Allowed 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 123.912 0.885 . . . . 0.0 111.538 179.431 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -45.14 -46.92 12.22 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.355 0.662 . . . . 0.0 111.853 -177.805 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 32.1 m -58.86 -39.88 82.66 Favored 'General case' 0 N--CA 1.455 -0.207 0 O-C-N 122.226 -0.296 . . . . 0.0 110.266 -178.512 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 20.2 mmt180 -70.42 -40.47 73.8 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 -178.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 13.4 m-80 -61.9 -39.73 93.02 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 178.208 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -61.21 -52.17 65.9 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 109.959 -0.386 . . . . 0.0 109.959 179.468 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 53.4 t -55.17 -50.69 62.01 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 N-CA-C 110.116 -0.327 . . . . 0.0 110.116 178.844 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 10.5 m95 -58.59 -40.71 83.99 Favored 'General case' 0 C--N 1.341 0.224 0 N-CA-C 110.368 -0.234 . . . . 0.0 110.368 -179.73 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -62.61 -49.77 73.89 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 179.473 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -56.07 -41.87 75.79 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 122.42 0.288 . . . . 0.0 110.421 179.936 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.403 ' HA ' ' CE1' ' A' ' 45' ' ' TYR . 37.3 mt -61.71 -34.47 62.37 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 N-CA-C 110.461 -0.2 . . . . 0.0 110.461 -179.805 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 4.1 ttpm? -83.0 -36.58 24.91 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 122.362 0.265 . . . . 0.0 110.708 -177.3 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -77.54 -47.79 18.63 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 122.191 0.196 . . . . 0.0 111.502 -177.076 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 79.0 mt -76.98 -29.6 55.6 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-O 119.74 -0.172 . . . . 0.0 110.842 -177.897 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 6.3 m-70 73.78 121.98 0.04 OUTLIER 'General case' 0 C--N 1.344 0.362 0 C-N-CA 123.27 0.628 . . . . 0.0 109.632 -178.612 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.403 ' CE1' ' HA ' ' A' ' 40' ' ' ILE . 3.4 m-85 . . . . . 0 N--CA 1.463 0.185 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 -179.724 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 7.1 mt . . . . . 0 C--O 1.219 -0.54 0 CA-C-O 119.677 -0.202 . . . . 0.0 110.819 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 20.8 ttpp -49.67 -55.75 12.65 Favored 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 111.879 0.325 . . . . 0.0 111.879 -176.754 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 -79.86 -42.28 24.58 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 118.247 0.476 . . . . 0.0 110.553 -176.652 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 28.6 t -57.33 -35.03 47.62 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.36 0 C-N-CA 122.442 0.297 . . . . 0.0 110.586 -180.0 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -52.93 -66.09 0.44 Allowed 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 123.224 0.609 . . . . 0.0 111.042 -178.59 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.95 -35.79 72.33 Favored 'General case' 0 C--N 1.334 -0.107 0 CA-C-O 119.592 -0.242 . . . . 0.0 110.435 -178.971 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 12.5 tpt180 -55.26 -40.35 70.86 Favored 'General case' 0 C--N 1.341 0.206 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 178.743 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -68.78 -62.75 1.25 Allowed 'General case' 0 N--CA 1.448 -0.558 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 177.615 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -177.58 -88.24 0.0 OUTLIER 'General case' 0 C--N 1.351 0.667 0 N-CA-C 112.066 0.395 . . . . 0.0 112.066 178.585 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 55.7 t -69.23 -86.38 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.343 0.291 0 C-N-CA 122.476 0.31 . . . . 0.0 111.205 -174.473 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 9.0 t -158.48 -157.94 0.67 Allowed 'General case' 0 N--CA 1.45 -0.437 0 N-CA-C 110.173 -0.306 . . . . 0.0 110.173 -177.421 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 38.0 p -55.82 -30.17 60.95 Favored 'General case' 0 C--N 1.341 0.221 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.188 -179.532 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 16.6 p -49.94 -44.51 50.5 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 122.756 0.422 . . . . 0.0 110.219 179.127 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 21.3 m -53.24 -36.26 60.88 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 122.43 0.292 . . . . 0.0 110.477 -179.686 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 25.8 t -80.86 -44.26 21.18 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.294 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 179.627 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 14.8 m -55.21 -32.23 62.08 Favored 'General case' 0 C--N 1.344 0.357 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 -179.427 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 62.4 m170 -54.83 -64.72 0.74 Allowed 'General case' 0 N--CA 1.445 -0.696 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.157 179.356 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 15.7 t -62.36 -27.82 43.43 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.246 0 C-N-CA 120.997 -0.281 . . . . 0.0 111.396 -176.495 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 6.1 mm -65.69 -51.68 59.47 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.518 0 CA-C-N 117.872 0.306 . . . . 0.0 110.826 -178.818 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -167.6 31.53 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 117.937 0.335 . . . . 0.0 111.556 -177.595 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 26.6 tptt -158.74 40.11 0.23 Allowed 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 120.69 -0.404 . . . . 0.0 110.624 -179.59 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 10.0 t -79.68 -31.02 41.3 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.664 -176.228 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 56.8 mtm180 57.36 -158.94 0.26 Allowed 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 109.549 -0.537 . . . . 0.0 109.549 179.962 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -80.4 99.17 7.83 Favored 'General case' 0 N--CA 1.453 -0.278 0 O-C-N 122.151 -0.343 . . . . 0.0 110.717 -178.006 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.0 m -143.69 161.55 16.26 Favored 'Isoleucine or valine' 0 C--O 1.233 0.221 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 175.955 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -74.0 170.17 15.98 Favored 'General case' 0 N--CA 1.446 -0.625 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 179.559 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 47.6 mm-40 -64.65 -18.01 64.56 Favored 'General case' 0 C--O 1.223 -0.306 0 N-CA-C 110.178 -0.304 . . . . 0.0 110.178 178.64 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -48.74 -55.14 12.3 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 122.943 0.497 . . . . 0.0 110.92 179.922 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 4.6 p -65.36 -41.22 94.07 Favored 'General case' 0 CA--C 1.531 0.243 0 O-C-N 122.378 -0.201 . . . . 0.0 111.045 -178.153 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 74.6 mtt85 -63.76 -53.66 47.56 Favored 'General case' 0 C--O 1.232 0.175 0 N-CA-C 111.375 0.139 . . . . 0.0 111.375 -177.205 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -69.36 -36.33 76.75 Favored 'General case' 0 C--O 1.223 -0.305 0 CA-C-O 119.677 -0.201 . . . . 0.0 110.732 -176.602 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -58.48 -50.69 72.83 Favored 'General case' 0 C--N 1.342 0.244 0 CA-C-N 117.843 0.292 . . . . 0.0 110.68 -178.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 48.7 t -58.06 -58.36 6.71 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.277 0 N-CA-C 110.559 -0.163 . . . . 0.0 110.559 -178.639 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 15.0 m95 -59.3 -40.26 85.65 Favored 'General case' 0 C--N 1.341 0.213 0 N-CA-C 110.747 -0.094 . . . . 0.0 110.747 -178.244 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -59.88 -50.8 72.35 Favored 'General case' 0 C--O 1.22 -0.455 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 -179.458 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -60.25 -47.74 84.71 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 122.026 0.131 . . . . 0.0 110.694 -179.199 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 58.5 mt -55.76 -47.41 79.41 Favored 'Isoleucine or valine' 0 C--N 1.341 0.2 0 C-N-CA 122.324 0.25 . . . . 0.0 111.105 -178.386 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -77.33 -41.14 41.67 Favored 'General case' 0 N--CA 1.448 -0.545 0 N-CA-C 110.372 -0.233 . . . . 0.0 110.372 -176.235 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -57.09 -48.46 78.56 Favored 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 110.161 -0.311 . . . . 0.0 110.161 -178.489 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 55.4 mt -83.7 -20.7 33.01 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.022 -178.458 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 91.4 m-70 55.89 26.53 9.85 Favored 'General case' 0 C--N 1.351 0.632 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 -176.956 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 16.6 t80 . . . . . 0 CA--C 1.535 0.374 0 C-N-CA 123.319 0.648 . . . . 0.0 109.772 -175.541 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.467 0.404 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 26.2 mmtp -46.53 -62.07 1.53 Allowed 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 122.837 0.455 . . . . 0.0 111.187 179.043 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 30.1 m-20 -91.17 -32.46 15.8 Favored 'General case' 0 C--N 1.347 0.468 0 CA-C-N 117.909 0.322 . . . . 0.0 111.425 -176.337 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 70.4 t -58.12 -42.97 84.46 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 179.222 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.94 -42.64 97.27 Favored 'General case' 0 C--O 1.22 -0.451 0 N-CA-C 110.372 -0.233 . . . . 0.0 110.372 179.823 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 41.3 mtpt -61.34 -47.51 85.57 Favored 'General case' 0 C--N 1.338 0.108 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 179.627 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -55.19 -39.89 70.09 Favored 'General case' 0 N--CA 1.454 -0.233 0 N-CA-C 109.492 -0.559 . . . . 0.0 109.492 179.602 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -70.31 -56.55 6.45 Favored 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 110.368 -0.234 . . . . 0.0 110.368 179.847 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 45.2 t30 -170.91 126.34 0.7 Allowed 'General case' 0 C--N 1.347 0.487 0 CA-C-N 117.387 0.085 . . . . 0.0 111.194 -177.743 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 51.3 t 51.68 -91.31 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.539 0 C-N-CA 123.895 0.878 . . . . 0.0 111.809 176.419 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 28.3 m -157.44 -169.93 3.06 Favored 'General case' 0 C--N 1.346 0.417 0 N-CA-C 109.785 -0.45 . . . . 0.0 109.785 -177.591 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 80.4 p -49.87 -26.7 4.3 Favored 'General case' 0 C--N 1.347 0.496 0 C-N-CA 123.212 0.605 . . . . 0.0 111.104 -179.771 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 18.6 p -50.25 -44.19 53.42 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 122.396 0.279 . . . . 0.0 110.289 179.063 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.3 t -59.88 -37.63 79.89 Favored 'General case' 0 CA--C 1.534 0.333 0 N-CA-C 110.563 -0.162 . . . . 0.0 110.563 -178.621 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 64.6 t -68.62 -45.6 81.29 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.246 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 179.821 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 20.2 m -57.16 -45.74 83.35 Favored 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 179.076 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 52.2 m170 -57.66 -46.32 84.38 Favored 'General case' 0 C--N 1.339 0.152 0 C-N-CA 122.353 0.261 . . . . 0.0 110.373 -179.743 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 32.9 t -65.41 -51.93 58.04 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.05 -178.101 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 94.9 mt -59.49 -54.1 39.14 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.217 0 N-CA-C 110.377 -0.231 . . . . 0.0 110.377 -177.912 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 43.5 m-80 -70.61 -18.98 62.88 Favored 'General case' 0 CA--C 1.532 0.288 0 N-CA-C 110.386 -0.227 . . . . 0.0 110.386 -179.007 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 74.2 tttt 61.05 46.14 8.56 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 122.878 0.471 . . . . 0.0 109.928 179.476 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 15.8 p -96.25 -80.18 0.43 Allowed 'General case' 0 C--N 1.341 0.199 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 179.632 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 78.7 ttt180 -78.81 100.76 7.29 Favored 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 108.968 -0.752 . . . . 0.0 108.968 179.15 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 90.8 t80 -62.11 144.13 55.73 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 109.967 -0.383 . . . . 0.0 109.967 -179.995 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 5.4 m -130.67 170.8 18.83 Favored 'Isoleucine or valine' 0 CA--C 1.523 -0.081 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 179.463 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -61.78 158.4 15.85 Favored 'General case' 0 N--CA 1.45 -0.449 0 N-CA-C 109.978 -0.379 . . . . 0.0 109.978 179.796 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 50.7 mm-40 -48.73 -45.01 38.9 Favored 'General case' 0 C--N 1.34 0.178 0 CA-C-N 116.042 -0.526 . . . . 0.0 109.889 179.049 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -52.85 -53.7 45.07 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 122.715 0.406 . . . . 0.0 111.436 -178.146 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 10.0 m -61.15 -51.94 66.96 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 117.804 0.274 . . . . 0.0 110.817 -177.179 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 30.9 ttp180 -58.53 -52.76 64.27 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 122.02 0.128 . . . . 0.0 110.798 -177.931 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 90.5 m-20 -63.34 -40.67 97.94 Favored 'General case' 0 N--CA 1.455 -0.189 0 N-CA-C 110.465 -0.198 . . . . 0.0 110.465 -178.025 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -61.14 -47.85 84.31 Favored 'General case' 0 C--O 1.224 -0.258 0 N-CA-C 110.284 -0.265 . . . . 0.0 110.284 -179.885 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 13.1 t -54.31 -52.41 39.08 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 179.926 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 26.0 m95 -62.85 -38.21 89.9 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 110.059 -0.348 . . . . 0.0 110.059 179.874 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -89.01 28.12 1.24 Allowed 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 122.251 0.22 . . . . 0.0 110.606 179.784 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -131.14 -46.63 1.01 Allowed 'General case' 0 N--CA 1.456 -0.14 0 N-CA-C 108.474 -0.936 . . . . 0.0 108.474 176.76 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 60.7 mt -55.48 -46.77 78.9 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.224 0 N-CA-C 109.839 -0.43 . . . . 0.0 109.839 178.902 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 4.6 ptpp? -107.81 32.93 4.36 Favored 'General case' 0 C--N 1.344 0.365 0 C-N-CA 122.144 0.178 . . . . 0.0 110.634 -178.609 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -138.77 -55.75 0.61 Allowed 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 179.181 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -85.18 13.67 6.06 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 110.048 -0.352 . . . . 0.0 110.048 179.309 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 3.8 t-80 78.39 149.95 0.11 Allowed 'General case' 0 N--CA 1.446 -0.632 0 CA-C-O 121.807 0.813 . . . . 0.0 110.88 177.644 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 26.2 t80 . . . . . 0 C--N 1.32 -0.692 0 CA-C-N 114.336 -1.302 . . . . 0.0 108.812 179.003 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 52.6 ttp . . . . . 0 N--CA 1.473 0.709 0 N-CA-C 109.754 -0.462 . . . . 0.0 109.754 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -157.01 163.88 38.6 Favored 'General case' 0 C--O 1.234 0.267 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 24.7 m -158.0 -64.74 0.09 Allowed 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 121.899 0.079 . . . . 0.0 110.911 -178.083 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.49 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 0.3 OUTLIER -152.03 -40.76 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.567 0 N-CA-C 109.94 -0.392 . . . . 0.0 109.94 -177.468 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 34.5 ttmt -55.55 -39.65 70.89 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 122.846 0.458 . . . . 0.0 111.081 -178.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -51.51 -64.93 0.65 Allowed 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 122.898 0.479 . . . . 0.0 111.414 -176.731 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 86.8 t -69.39 -31.81 50.87 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.371 0 N-CA-C 110.646 -0.131 . . . . 0.0 110.646 -177.211 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.04 -41.97 97.58 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 110.267 -0.272 . . . . 0.0 110.267 -179.888 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 31.4 mmtm -81.3 -31.58 33.53 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 122.439 0.296 . . . . 0.0 110.822 -179.168 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 1.3 tpm_? -75.64 -47.52 26.07 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 117.427 0.103 . . . . 0.0 111.047 -177.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -80.68 -49.03 11.74 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 122.163 0.185 . . . . 0.0 111.006 -177.073 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 22.4 m-80 -123.66 -145.41 0.34 Allowed 'General case' 0 C--N 1.341 0.23 0 N-CA-C 109.735 -0.469 . . . . 0.0 109.735 -177.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 58.6 t -102.22 -41.95 8.42 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.249 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 -179.902 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 8.3 t -155.16 176.85 12.02 Favored 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 109.925 -0.398 . . . . 0.0 109.925 -179.752 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 12.6 m -61.47 -21.47 64.2 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.617 -179.284 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 3.7 m -52.18 -49.16 64.38 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 110.179 -0.304 . . . . 0.0 110.179 179.379 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 7.1 m -65.43 -33.32 75.66 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 122.148 0.179 . . . . 0.0 110.722 -179.369 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 58.5 t -68.32 -45.58 82.31 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 -179.79 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 60.4 p -60.42 -35.72 76.47 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-O 119.731 -0.176 . . . . 0.0 110.739 -178.787 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 55.0 m170 -52.61 -37.54 58.45 Favored 'General case' 0 C--N 1.347 0.466 0 CA-C-O 120.568 0.223 . . . . 0.0 110.631 -179.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 60.1 t -72.35 -40.2 64.37 Favored 'Isoleucine or valine' 0 C--O 1.234 0.278 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.493 -178.88 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 76.2 mt -68.84 -56.18 13.04 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.194 0 C-N-CA 122.405 0.282 . . . . 0.0 110.514 -177.854 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 31.1 p30 -76.55 -10.92 59.74 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 119.701 -0.19 . . . . 0.0 111.216 -177.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 39.7 mtmt 56.45 38.7 29.91 Favored 'General case' 0 C--N 1.345 0.411 0 C-N-CA 122.674 0.389 . . . . 0.0 110.319 179.257 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 10.3 t -82.23 -34.18 28.97 Favored 'General case' 0 C--N 1.34 0.155 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 179.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 89.2 mtt-85 -134.18 69.97 1.46 Allowed 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 178.236 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 87.5 t80 -59.47 111.16 1.29 Allowed 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 116.097 -0.501 . . . . 0.0 109.78 -179.038 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 12.0 t -76.13 173.68 0.93 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 179.31 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -76.89 52.61 0.87 Allowed 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 122.337 0.255 . . . . 0.0 111.455 -178.056 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 69.08 -32.16 0.22 Allowed 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.025 0.93 . . . . 0.0 112.975 177.023 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 51.6 mt-10 -50.87 -61.93 1.91 Allowed 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 118.52 0.6 . . . . 0.0 110.836 -177.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 45.5 m -61.14 -41.19 96.29 Favored 'General case' 0 C--O 1.225 -0.204 0 CA-C-N 116.738 -0.21 . . . . 0.0 110.599 -178.482 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 12.1 ttm180 -56.04 -55.39 33.4 Favored 'General case' 0 CA--C 1.531 0.247 0 N-CA-C 110.286 -0.265 . . . . 0.0 110.286 -179.152 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 21.5 m120 -61.84 -46.05 91.14 Favored 'General case' 0 N--CA 1.455 -0.201 0 N-CA-C 110.282 -0.266 . . . . 0.0 110.282 -179.353 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -56.84 -43.07 80.74 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 122.194 0.198 . . . . 0.0 110.785 -179.12 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 16.4 t -63.43 -57.47 11.72 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.184 0 N-CA-C 110.339 -0.245 . . . . 0.0 110.339 -178.875 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 19.0 m95 -58.87 -37.79 77.35 Favored 'General case' 0 CA--C 1.53 0.197 0 N-CA-C 110.682 -0.118 . . . . 0.0 110.682 -178.466 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -66.02 -53.13 42.52 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 109.953 -0.388 . . . . 0.0 109.953 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.96 -41.62 87.93 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 122.54 0.336 . . . . 0.0 110.893 -178.611 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 19.7 mt -53.37 -46.14 57.67 Favored 'Isoleucine or valine' 0 C--N 1.34 0.194 0 C-N-CA 122.218 0.207 . . . . 0.0 110.547 -179.38 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 7.8 mtpm? -79.82 -37.35 35.28 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 110.303 -0.258 . . . . 0.0 110.303 -177.848 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -59.34 -57.28 13.68 Favored 'General case' 0 N--CA 1.451 -0.379 0 N-CA-C 110.109 -0.33 . . . . 0.0 110.109 -178.523 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -70.91 -43.21 68.76 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 -179.68 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 9.9 t60 65.03 118.72 0.02 OUTLIER 'General case' 0 C--N 1.349 0.567 0 C-N-CA 123.462 0.705 . . . . 0.0 110.091 -178.834 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.49 ' CE2' ' HA ' ' A' ' 4' ' ' ILE . 0.0 OUTLIER -156.46 50.32 0.5 Allowed 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.276 -179.4 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 10.4 t -50.99 119.25 11.61 Favored Pre-proline 0 CA--C 1.537 0.457 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.058 -179.171 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 4.5 Cg_endo -64.0 -26.3 66.27 Favored 'Trans proline' 0 N--CA 1.451 -1.019 0 C-N-CA 122.48 2.12 . . . . 0.0 110.885 -179.801 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 50.6 m -148.96 138.83 22.03 Favored 'General case' 0 N--CA 1.455 -0.202 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 179.395 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . 64.78 91.0 0.08 Allowed 'General case' 0 C--N 1.343 0.284 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 -178.63 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 8.0 p -65.65 -30.61 50.64 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.377 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.711 -179.149 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -60.33 -66.33 0.54 Allowed 'General case' 0 C--N 1.342 0.269 0 N-CA-C 110.369 -0.234 . . . . 0.0 110.369 -179.162 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 31.2 ttt180 -163.26 -143.8 0.08 Allowed 'General case' 0 N--CA 1.449 -0.497 0 N-CA-C 108.544 -0.91 . . . . 0.0 108.544 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 30.8 p -169.11 112.6 0.53 Allowed 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 -179.588 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -159.39 159.42 33.75 Favored 'General case' 0 N--CA 1.455 -0.187 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 179.795 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 12.3 tptp 57.2 -148.52 0.49 Allowed 'General case' 0 CA--C 1.538 0.519 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 19.2 m . . . . . 0 C--O 1.25 1.11 0 CA-C-O 117.01 -1.471 . . . . 0.0 108.92 179.905 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 20.8 ptm . . . . . 0 N--CA 1.475 0.801 0 N-CA-C 110.053 -0.351 . . . . 0.0 110.053 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 71.47 146.2 0.07 Allowed 'General case' 0 C--N 1.344 0.354 0 C-N-CA 123.315 0.646 . . . . 0.0 110.41 -179.809 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 68.4 m -163.1 -51.78 0.04 OUTLIER 'General case' 0 C--N 1.342 0.257 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 -178.865 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 15.3 tt -47.64 -33.47 3.29 Favored 'Isoleucine or valine' 0 C--N 1.349 0.581 0 C-N-CA 123.326 0.651 . . . . 0.0 111.214 -179.468 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 3.6 mmmm -70.19 -58.96 3.19 Favored 'General case' 0 N--CA 1.447 -0.576 0 N-CA-C 110.175 -0.305 . . . . 0.0 110.175 -179.735 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -59.83 -56.75 17.89 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 123.403 0.44 . . . . 0.0 111.749 -176.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 17.1 m -43.55 -56.07 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 C-N-CA 122.83 0.452 . . . . 0.0 112.196 -174.039 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -48.17 -50.24 29.7 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.769 -178.329 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 8.5 mptt -74.66 -34.32 62.69 Favored 'General case' 0 CA--C 1.534 0.347 0 O-C-N 122.436 -0.165 . . . . 0.0 110.736 -178.496 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 11.0 mmt-85 -58.78 -56.19 25.4 Favored 'General case' 0 C--N 1.341 0.205 0 N-CA-C 109.502 -0.555 . . . . 0.0 109.502 179.093 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -68.96 -8.23 42.64 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.688 179.498 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 60.9 63.11 1.33 Allowed 'General case' 0 C--N 1.343 0.291 0 C-N-CA 123.018 0.527 . . . . 0.0 110.254 178.963 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 2.1 m -137.2 -109.48 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.455 -0.191 0 N-CA-C 108.518 -0.919 . . . . 0.0 108.518 177.677 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 10.0 p -169.25 147.05 3.67 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 179.812 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 9.3 t -51.39 -33.06 28.38 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.534 179.552 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 20.2 p -49.83 -54.21 20.76 Favored 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 109.863 -0.421 . . . . 0.0 109.863 179.075 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 10.5 m -53.31 -46.05 69.23 Favored 'General case' 0 N--CA 1.456 -0.151 0 C-N-CA 122.63 0.372 . . . . 0.0 110.094 179.466 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 20.1 t -64.85 -27.08 41.62 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.18 0 CA-C-N 116.433 -0.348 . . . . 0.0 110.824 -178.577 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 45.2 m -77.42 -48.86 16.12 Favored 'General case' 0 CA--C 1.506 -0.732 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 179.844 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 18.2 m-70 -55.54 -39.82 71.08 Favored 'General case' 0 C--O 1.201 -1.47 0 O-C-N 123.329 0.393 . . . . 0.0 110.046 -179.626 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 19.6 t -52.16 -32.89 16.12 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.389 0 CA-C-N 118.192 0.451 . . . . 0.0 110.784 -179.367 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 32.1 mm -75.33 -34.96 31.89 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.415 0 N-CA-C 111.989 0.366 . . . . 0.0 111.989 -177.738 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.3 p-10 -100.56 -40.32 7.47 Favored 'General case' 0 N--CA 1.481 1.097 0 CA-C-N 118.398 0.545 . . . . 0.0 111.337 -176.486 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.448 ' O ' ' CG2' ' A' ' 25' ' ' THR . 36.2 ttpt -153.74 -89.89 0.05 OUTLIER 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 108.13 -1.063 . . . . 0.0 108.13 179.142 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' THR . . . . . 0.448 ' CG2' ' O ' ' A' ' 24' ' ' LYS . 0.8 OUTLIER 173.53 -41.75 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.294 0.637 . . . . 0.0 110.283 177.605 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 38.3 ttt85 57.91 46.12 17.22 Favored 'General case' 0 CA--C 1.535 0.385 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 -178.099 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 22.5 t80 74.19 126.18 0.04 OUTLIER 'General case' 0 C--N 1.346 0.456 0 C-N-CA 123.615 0.766 . . . . 0.0 110.684 -179.804 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 5.8 m -141.96 168.06 15.17 Favored 'Isoleucine or valine' 0 C--N 1.342 0.254 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 178.766 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -100.59 25.78 7.43 Favored 'General case' 0 CA--C 1.531 0.218 0 N-CA-C 109.897 -0.409 . . . . 0.0 109.897 179.38 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 68.5 -65.81 0.26 Allowed 'General case' 0 C--N 1.352 0.684 0 C-N-CA 123.909 0.883 . . . . 0.0 110.704 -179.398 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 68.1 mt-10 -53.54 -33.71 55.59 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 122.775 0.43 . . . . 0.0 110.803 -179.824 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 9.9 p -66.8 -54.81 18.76 Favored 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 -179.374 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 2.4 tmt_? -55.53 -45.64 77.14 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 110.079 -0.341 . . . . 0.0 110.079 179.821 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 86.6 m-20 -64.43 -48.74 74.2 Favored 'General case' 0 CA--C 1.53 0.199 0 N-CA-C 110.493 -0.188 . . . . 0.0 110.493 -179.073 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -58.04 -43.63 86.91 Favored 'General case' 0 C--N 1.34 0.157 0 N-CA-C 110.336 -0.246 . . . . 0.0 110.336 -179.455 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 21.7 t -56.81 -54.21 32.44 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.214 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 179.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 18.0 m95 -60.66 -39.88 90.01 Favored 'General case' 0 N--CA 1.456 -0.154 0 N-CA-C 110.568 -0.16 . . . . 0.0 110.568 -179.532 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -58.83 -52.37 66.01 Favored 'General case' 0 N--CA 1.455 -0.193 0 N-CA-C 109.946 -0.39 . . . . 0.0 109.946 -179.067 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -62.62 -44.52 96.08 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 122.294 0.238 . . . . 0.0 110.508 -179.774 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 29.4 mt -58.12 -39.11 71.45 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.196 0 N-CA-C 110.247 -0.279 . . . . 0.0 110.247 -179.658 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 65.2 mmtt -78.1 -34.11 50.27 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 109.925 -0.398 . . . . 0.0 109.925 -178.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -63.85 -58.48 6.66 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 110.407 -0.22 . . . . 0.0 110.407 -178.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 79.2 mt -85.62 -2.13 57.85 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 122.223 0.209 . . . . 0.0 110.913 -178.547 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 4.4 m-70 63.71 13.37 7.34 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 123.137 0.575 . . . . 0.0 110.767 -179.42 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 7.6 t80 32.42 57.95 0.39 Allowed 'General case' 0 C--N 1.347 0.472 0 C-N-CA 124.035 0.934 . . . . 0.0 111.153 -178.7 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 13.4 m -77.63 121.01 83.66 Favored Pre-proline 0 CA--C 1.535 0.375 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -69.29 -59.6 0.09 OUTLIER 'Trans proline' 0 N--CA 1.446 -1.28 0 C-N-CA 122.328 2.019 . . . . 0.0 110.027 179.578 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 13.9 m -89.65 -174.02 4.16 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.007 -179.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -148.77 -47.54 0.15 Allowed 'General case' 0 C--N 1.341 0.235 0 N-CA-C 109.739 -0.467 . . . . 0.0 109.739 179.682 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 5.2 m -73.93 70.8 0.25 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 CA-C-O 121.016 0.436 . . . . 0.0 110.041 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -161.91 -42.8 0.04 OUTLIER 'General case' 0 N--CA 1.456 -0.17 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 -179.883 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 14.2 ttt85 -146.94 -145.1 0.16 Allowed 'General case' 0 N--CA 1.449 -0.508 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 179.629 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 36.3 t -172.26 -62.22 0.02 OUTLIER 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 108.577 -0.898 . . . . 0.0 108.577 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 10.4 mp -86.27 168.79 13.59 Favored 'General case' 0 N--CA 1.455 -0.225 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 178.634 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 7.2 mtmp? -71.13 -173.63 0.87 Allowed 'General case' 0 C--O 1.235 0.311 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 179.635 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 16.8 m . . . . . 0 C--O 1.257 1.46 0 CA-C-O 116.838 -1.553 . . . . 0.0 109.097 178.21 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 91.6 mtp . . . . . 0 N--CA 1.473 0.699 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 54.87 61.17 3.08 Favored 'General case' 0 C--N 1.344 0.348 0 O-C-N 123.348 0.405 . . . . 0.0 110.191 -179.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 17.4 p -123.89 -59.93 1.48 Allowed 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 179.834 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -56.4 -45.07 81.58 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.437 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 179.913 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 27.1 mmtp -59.52 -58.79 7.04 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 120.733 0.301 . . . . 0.0 110.381 -178.552 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -57.36 -50.64 72.32 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.624 -179.121 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 29.3 t -53.66 -54.51 18.74 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.092 0 C-N-CA 123.045 0.538 . . . . 0.0 110.491 -179.715 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -55.09 -58.61 6.95 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.728 -177.332 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 32.6 mtmm -59.63 -34.57 72.95 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 110.422 -0.214 . . . . 0.0 110.422 -177.775 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 49.2 tpt85 -64.91 -35.12 80.13 Favored 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 177.061 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -84.56 8.21 17.42 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 122.691 0.396 . . . . 0.0 110.256 178.236 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 8.1 t-20 69.98 42.42 1.02 Allowed 'General case' 0 C--N 1.346 0.447 0 C-N-CA 123.974 0.909 . . . . 0.0 111.454 177.424 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 3.6 m -145.16 143.35 22.27 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.518 0 N-CA-C 108.21 -1.033 . . . . 0.0 108.21 176.03 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 74.3 m -71.7 -65.65 0.73 Allowed 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.865 -0.42 . . . . 0.0 109.865 -178.257 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 5.2 t 179.71 -33.02 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 123.964 0.905 . . . . 0.0 108.869 -179.753 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 11.7 p -57.84 -49.08 77.89 Favored 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 178.272 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 12.0 m -56.76 -36.09 69.4 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 110.228 -0.286 . . . . 0.0 110.228 179.215 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 71.6 t -69.99 -38.47 75.42 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.178 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 178.218 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 17.4 m -61.66 -33.36 73.84 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 109.755 -0.461 . . . . 0.0 109.755 179.152 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 50.8 m170 -61.29 -30.48 70.51 Favored 'General case' 0 C--N 1.346 0.431 0 N-CA-C 110.385 -0.228 . . . . 0.0 110.385 179.496 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 93.1 t -63.96 -52.04 61.67 Favored 'Isoleucine or valine' 0 C--N 1.341 0.215 0 N-CA-C 109.522 -0.547 . . . . 0.0 109.522 179.911 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 4.8 mm -64.41 -49.96 78.42 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.164 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 179.656 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 33.8 t-20 -59.86 -31.75 70.06 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 116.528 -0.305 . . . . 0.0 110.205 -179.262 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 31.9 ttpt 64.34 46.02 3.61 Favored 'General case' 0 CA--C 1.532 0.282 0 N-CA-C 109.503 -0.555 . . . . 0.0 109.503 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 15.2 p -115.55 -87.06 0.6 Allowed 'General case' 0 C--N 1.341 0.233 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 -179.847 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 47.5 mmm-85 -94.73 54.6 1.78 Allowed 'General case' 0 C--O 1.233 0.22 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 -179.34 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 27.6 p90 -72.57 144.24 47.98 Favored 'General case' 0 N--CA 1.453 -0.287 0 N-CA-C 109.379 -0.601 . . . . 0.0 109.379 179.7 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 19.7 t -87.54 80.1 1.77 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.286 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 -179.548 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 54.55 -143.33 0.74 Allowed 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.203 179.397 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 69.1 mt-10 -115.05 -25.27 8.2 Favored 'General case' 0 CA--C 1.528 0.125 0 C-N-CA 122.892 0.477 . . . . 0.0 110.284 179.705 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 70.0 mm-40 -55.24 -61.8 2.09 Favored 'General case' 0 C--O 1.232 0.163 0 N-CA-C 110.148 -0.315 . . . . 0.0 110.148 -179.783 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 9.6 m -62.65 -40.1 95.96 Favored 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 179.925 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 13.9 ttm180 -52.03 -48.96 64.3 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 122.701 0.4 . . . . 0.0 110.308 -179.657 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 22.4 t-20 -71.09 -47.52 57.76 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.336 -179.174 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -54.63 -39.79 68.31 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 122.42 0.288 . . . . 0.0 110.945 -178.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 17.5 t -60.39 -60.88 1.91 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.279 0 N-CA-C 109.84 -0.43 . . . . 0.0 109.84 -179.524 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 26.0 m95 -58.34 -37.33 74.94 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-O 119.969 -0.062 . . . . 0.0 110.946 -178.196 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -61.37 -55.93 26.07 Favored 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 109.808 -0.442 . . . . 0.0 109.808 179.069 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.5 -42.49 87.78 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 122.611 0.364 . . . . 0.0 110.895 -179.033 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 27.4 mt -52.71 -56.87 5.51 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.193 0 C-N-CA 122.54 0.336 . . . . 0.0 110.703 -178.779 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -83.67 0.09 48.47 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-O 119.6 -0.238 . . . . 0.0 111.541 -176.818 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.6 tm-20 -88.7 -46.48 8.98 Favored 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 109.181 -0.674 . . . . 0.0 109.181 179.435 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 6.9 mt -72.38 -92.32 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 119.27 -0.395 . . . . 0.0 110.71 -178.514 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 54.9 m80 -158.79 18.0 0.2 Allowed 'General case' 0 C--N 1.352 0.694 0 N-CA-C 112.763 0.653 . . . . 0.0 112.763 -175.608 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 66.7 t80 -67.46 109.98 3.43 Favored 'General case' 0 N--CA 1.464 0.234 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 179.003 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 31.4 t -158.64 85.72 2.41 Favored Pre-proline 0 N--CA 1.453 -0.312 0 N-CA-C 109.826 -0.435 . . . . 0.0 109.826 -179.348 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 10.8 Cg_endo -72.11 76.06 2.2 Favored 'Trans proline' 0 N--CA 1.447 -1.253 0 C-N-CA 122.651 2.234 . . . . 0.0 109.501 178.569 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 12.3 t -93.12 158.22 15.88 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.31 -178.772 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . 63.04 20.96 12.62 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.304 0.642 . . . . 0.0 111.255 179.366 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 26.8 m -144.63 147.03 19.65 Favored 'Isoleucine or valine' 0 C--N 1.341 0.235 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 178.75 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -165.46 -112.19 0.01 OUTLIER 'General case' 0 N--CA 1.455 -0.175 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 179.63 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 17.5 ptm180 -67.19 -24.34 65.85 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 177.738 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 29.5 m -140.18 175.33 9.68 Favored 'General case' 0 C--N 1.344 0.327 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 179.132 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -80.05 176.76 9.46 Favored 'General case' 0 N--CA 1.454 -0.23 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 179.3 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 60.3 pttt -62.68 -25.13 68.0 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 110.396 -0.224 . . . . 0.0 110.396 179.462 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 7.5 p . . . . . 0 C--O 1.253 1.258 0 CA-C-O 116.567 -1.683 . . . . 0.0 108.927 179.574 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 45.1 ttm . . . . . 0 N--CA 1.476 0.861 0 N-CA-C 109.931 -0.396 . . . . 0.0 109.931 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -65.49 80.58 0.06 Allowed 'General case' 0 C--N 1.343 0.292 0 C-N-CA 122.661 0.385 . . . . 0.0 110.899 -178.476 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -156.82 29.33 0.32 Allowed 'General case' 0 N--CA 1.468 0.438 0 N-CA-C 110.111 -0.329 . . . . 0.0 110.111 -179.64 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.1 mt 57.8 24.86 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.625 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 -177.198 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -82.29 -58.06 3.1 Favored 'General case' 0 N--CA 1.45 -0.454 0 C-N-CA 123.412 0.685 . . . . 0.0 110.41 -177.588 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 32.9 m-20 -82.23 -34.24 28.95 Favored 'General case' 0 C--O 1.224 -0.268 0 N-CA-C 110.377 -0.231 . . . . 0.0 110.377 -177.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 31.2 t -54.16 -52.56 36.48 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.259 0 N-CA-C 110.092 -0.336 . . . . 0.0 110.092 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.65 -45.73 88.84 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-O 120.499 0.19 . . . . 0.0 110.663 -178.853 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 18.3 mmtp -67.1 -24.71 65.96 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-O 119.614 -0.231 . . . . 0.0 111.224 -178.132 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 1.6 tmm_? -60.65 -43.61 97.38 Favored 'General case' 0 C--N 1.343 0.316 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 177.887 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -85.18 -0.28 54.08 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 178.466 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 67.39 48.73 1.11 Allowed 'General case' 0 C--N 1.345 0.411 0 C-N-CA 123.202 0.601 . . . . 0.0 110.268 178.651 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 27.6 m -143.22 174.1 5.28 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 178.531 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 21.3 m -88.69 161.84 16.62 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 122.672 0.389 . . . . 0.0 110.074 -179.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 14.1 t -56.4 -32.35 64.73 Favored 'General case' 0 N--CA 1.463 0.223 0 C-N-CA 122.509 0.324 . . . . 0.0 110.763 -179.851 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 13.8 p -58.86 -45.62 89.69 Favored 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 178.823 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -55.94 -42.35 76.03 Favored 'General case' 0 N--CA 1.453 -0.278 0 N-CA-C 109.884 -0.413 . . . . 0.0 109.884 179.612 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 78.5 t -64.87 -43.47 96.33 Favored 'Isoleucine or valine' 0 C--N 1.34 0.177 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 179.185 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 14.4 t -57.67 -37.25 73.09 Favored 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 110.151 -0.314 . . . . 0.0 110.151 179.622 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 54.7 m170 -59.13 -28.07 66.21 Favored 'General case' 0 C--N 1.344 0.332 0 N-CA-C 110.398 -0.223 . . . . 0.0 110.398 -179.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 36.7 t -77.79 -43.69 29.0 Favored 'Isoleucine or valine' 0 C--O 1.232 0.154 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 178.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 77.2 mt -57.98 -58.42 6.44 Favored 'Isoleucine or valine' 0 C--N 1.34 0.163 0 N-CA-C 109.519 -0.548 . . . . 0.0 109.519 -179.436 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 26.5 p30 -73.84 -14.42 61.08 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 110.283 -0.266 . . . . 0.0 110.283 -179.849 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 62.22 32.63 17.15 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 122.978 0.511 . . . . 0.0 111.254 177.035 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 14.8 t -70.23 -29.32 66.12 Favored 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 177.56 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 74.3 mtt85 -141.81 98.33 3.32 Favored 'General case' 0 C--N 1.343 0.309 0 N-CA-C 108.115 -1.069 . . . . 0.0 108.115 178.148 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 88.5 t80 -65.88 108.6 2.21 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 110.234 -0.284 . . . . 0.0 110.234 -178.601 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 30.3 m -72.82 172.88 0.96 Allowed 'Isoleucine or valine' 0 N--CA 1.457 -0.118 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 178.235 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -65.03 159.3 23.44 Favored 'General case' 0 N--CA 1.449 -0.477 0 N-CA-C 109.684 -0.487 . . . . 0.0 109.684 178.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 29.5 mm-40 -50.63 -43.01 56.86 Favored 'General case' 0 C--O 1.223 -0.336 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.155 179.473 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 9.5 tm-20 -52.17 -53.23 45.68 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 122.217 0.207 . . . . 0.0 110.632 -179.364 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 10.0 m -65.55 -52.66 50.75 Favored 'General case' 0 N--CA 1.442 -0.855 0 CA-C-O 119.593 -0.242 . . . . 0.0 111.453 -175.25 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 6.8 ppt_? -62.19 -39.51 92.97 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 118.277 0.49 . . . . 0.0 110.958 -176.784 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 49.2 m-80 -67.17 -46.61 73.47 Favored 'General case' 0 C--N 1.34 0.194 0 N-CA-C 109.549 -0.537 . . . . 0.0 109.549 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -58.64 -42.01 87.36 Favored 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 110.21 -0.293 . . . . 0.0 110.21 179.717 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 18.8 t -63.94 -58.3 7.92 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.216 0 C-N-CA 122.381 0.272 . . . . 0.0 110.314 -179.514 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 19.3 m95 -57.87 -37.76 74.51 Favored 'General case' 0 C--N 1.342 0.261 0 N-CA-C 110.444 -0.206 . . . . 0.0 110.444 -178.371 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -64.13 -52.55 58.59 Favored 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 179.266 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -55.74 -45.46 78.0 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 122.449 0.3 . . . . 0.0 111.038 -178.602 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 46.5 mt -55.26 -43.53 71.33 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 C-N-CA 122.2 0.2 . . . . 0.0 110.985 -178.116 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 36.6 mtmm -78.32 -43.54 27.61 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 109.983 -0.377 . . . . 0.0 109.983 -177.541 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 24.0 mm-40 -57.15 -47.77 80.36 Favored 'General case' 0 N--CA 1.448 -0.542 0 O-C-N 123.152 0.282 . . . . 0.0 110.761 -178.466 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -85.52 -0.68 55.69 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-O 119.669 -0.205 . . . . 0.0 110.636 -178.876 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 21.2 m80 57.14 38.47 29.01 Favored 'General case' 0 C--N 1.345 0.406 0 C-N-CA 122.651 0.38 . . . . 0.0 110.689 178.687 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 1.5 m-85 -58.64 108.23 0.61 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.258 179.791 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 23.1 t -130.99 79.95 70.41 Favored Pre-proline 0 N--CA 1.449 -0.479 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 178.025 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 3.6 Cg_exo -59.79 154.62 48.42 Favored 'Trans proline' 0 N--CA 1.449 -1.104 0 C-N-CA 122.536 2.157 . . . . 0.0 110.332 -179.223 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 4.7 t 73.78 105.12 0.07 Allowed 'General case' 0 C--N 1.344 0.359 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 -178.395 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . 69.84 -175.44 0.19 Allowed 'General case' 0 C--N 1.341 0.231 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 -178.204 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 4.1 t 51.77 55.36 0.36 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 -179.014 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -77.77 73.67 4.33 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 116.174 -0.466 . . . . 0.0 109.901 -179.103 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 51.9 ttt180 76.65 -55.48 0.57 Allowed 'General case' 0 C--N 1.343 0.307 0 C-N-CA 123.477 0.711 . . . . 0.0 110.22 179.415 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 16.5 m 56.71 63.71 1.87 Allowed 'General case' 0 C--N 1.342 0.24 0 C-N-CA 122.722 0.409 . . . . 0.0 110.305 179.166 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 43.8 mt -59.75 146.91 39.81 Favored 'General case' 0 C--O 1.232 0.141 0 N-CA-C 109.827 -0.435 . . . . 0.0 109.827 179.887 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -159.76 41.73 0.2 Allowed 'General case' 0 CA--C 1.531 0.214 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 -179.784 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 57.2 t . . . . . 0 C--O 1.253 1.258 0 CA-C-O 116.658 -1.639 . . . . 0.0 108.831 -179.853 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 51.7 tpp . . . . . 0 N--CA 1.472 0.655 0 N-CA-C 109.63 -0.507 . . . . 0.0 109.63 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -137.38 81.01 1.84 Allowed 'General case' 0 C--N 1.341 0.202 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 -179.607 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 47.3 p -127.19 175.2 8.32 Favored 'General case' 0 CA--C 1.531 0.216 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 179.636 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 21.3 tt -55.12 -32.47 27.76 Favored 'Isoleucine or valine' 0 C--N 1.344 0.369 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 179.144 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -60.47 -60.25 4.11 Favored 'General case' 0 N--CA 1.447 -0.608 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 178.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 29.2 m-20 -54.22 -43.36 70.75 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.262 179.379 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 42.8 t -59.53 -36.67 66.12 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.28 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 178.409 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -68.11 -40.04 82.63 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 110.273 -0.269 . . . . 0.0 110.273 179.755 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 52.9 mttt -62.48 -40.44 96.69 Favored 'General case' 0 C--N 1.343 0.289 0 N-CA-C 108.485 -0.931 . . . . 0.0 108.485 177.733 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 27.1 mtt180 -60.03 -43.58 95.2 Favored 'General case' 0 C--N 1.341 0.229 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 176.415 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -73.77 9.85 1.33 Allowed 'General case' 0 CA--C 1.541 0.635 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.632 177.023 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 8.1 m-80 75.07 149.19 0.1 Allowed 'General case' 0 C--N 1.353 0.739 0 C-N-CA 124.296 1.038 . . . . 0.0 111.613 177.199 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 40.8 t 64.02 -86.6 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.455 -0.18 0 CA-C-N 114.393 -1.276 . . . . 0.0 110.559 177.116 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 9.3 t -174.88 -162.74 0.12 Allowed 'General case' 0 C--O 1.233 0.234 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 -177.045 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 20.0 p -57.91 -19.93 33.49 Favored 'General case' 0 C--O 1.222 -0.347 0 C-N-CA 123.133 0.573 . . . . 0.0 111.314 -179.282 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 4.6 m -53.5 -49.51 67.38 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 110.277 -0.268 . . . . 0.0 110.277 179.668 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 26.1 m -62.4 -44.3 96.78 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 110.296 -0.261 . . . . 0.0 110.296 -179.289 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 92.6 t -61.29 -42.25 92.84 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 -179.839 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 50.3 m -61.3 -40.72 95.21 Favored 'General case' 0 N--CA 1.454 -0.243 0 N-CA-C 110.159 -0.311 . . . . 0.0 110.159 -179.496 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 47.0 m170 -59.36 -41.3 88.93 Favored 'General case' 0 C--N 1.339 0.149 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 -179.825 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 54.0 t -70.47 -52.48 28.93 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 O-C-N 123.035 0.21 . . . . 0.0 110.791 -178.674 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 93.1 mt -63.44 -51.87 65.22 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 N-CA-C 110.393 -0.225 . . . . 0.0 110.393 -177.635 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 14.6 t-20 -68.56 -34.88 76.6 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-O 119.665 -0.207 . . . . 0.0 110.517 -178.483 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 23.1 mtmm 70.56 60.09 0.22 Allowed 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 123.373 0.669 . . . . 0.0 109.507 -179.398 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 19.3 p -87.33 -80.35 0.26 Allowed 'General case' 0 C--N 1.34 0.167 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 179.201 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 8.7 ptm180 -86.76 163.1 17.48 Favored 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 109.843 -0.429 . . . . 0.0 109.843 179.41 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 89.1 t80 -80.99 142.25 33.62 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 179.617 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 9.0 m -141.17 158.19 22.61 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.183 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 178.544 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -73.22 160.2 32.28 Favored 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 179.499 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 15.1 mm-40 -58.53 -24.38 60.47 Favored 'General case' 0 C--O 1.223 -0.298 0 N-CA-C 110.099 -0.334 . . . . 0.0 110.099 179.071 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.7 tm-20 -56.21 -53.01 62.28 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 109.705 -0.48 . . . . 0.0 109.705 178.034 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 3.9 m -64.03 -48.68 75.35 Favored 'General case' 0 N--CA 1.449 -0.517 0 C-N-CA 122.247 0.219 . . . . 0.0 110.477 -177.487 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 28.3 mtm180 -57.84 -54.25 48.99 Favored 'General case' 0 CA--C 1.528 0.119 0 N-CA-C 110.051 -0.351 . . . . 0.0 110.051 -179.16 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 48.6 t30 -57.73 -48.82 78.51 Favored 'General case' 0 C--O 1.224 -0.272 0 C-N-CA 122.785 0.434 . . . . 0.0 110.339 -178.828 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -55.85 -47.16 77.77 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 122.112 0.165 . . . . 0.0 110.651 -178.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 39.2 t -63.44 -56.4 17.29 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.15 0 N-CA-C 110.474 -0.195 . . . . 0.0 110.474 -178.82 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 19.5 m95 -57.21 -40.19 76.99 Favored 'General case' 0 C--O 1.233 0.202 0 N-CA-C 110.516 -0.179 . . . . 0.0 110.516 -178.56 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -64.09 -49.59 71.65 Favored 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 -179.781 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -70.44 0.15 7.21 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-O 119.499 -0.286 . . . . 0.0 111.536 -178.68 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 21.8 mt -102.91 -46.72 10.83 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.195 0 N-CA-C 109.899 -0.408 . . . . 0.0 109.899 178.895 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 1.1 ttpm? -93.19 -30.35 15.26 Favored 'General case' 0 C--N 1.343 0.318 0 N-CA-C 112.25 0.463 . . . . 0.0 112.25 -176.078 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 49.5 mm-40 -86.46 -30.56 21.93 Favored 'General case' 0 C--N 1.34 0.172 0 CA-C-N 118.371 0.532 . . . . 0.0 110.558 -177.72 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -73.76 -29.1 62.02 Favored 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 110.356 -0.239 . . . . 0.0 110.356 -179.323 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . 0.435 ' C ' ' H ' ' A' ' 46' ' ' SER . 19.1 m80 59.57 57.73 3.16 Favored 'General case' 0 C--N 1.346 0.426 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 -179.481 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 9.2 p90 -71.6 17.25 0.09 Allowed 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.896 -178.631 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' SER . . . . . 0.435 ' H ' ' C ' ' A' ' 44' ' ' HIS . 34.0 t 55.14 69.94 1.81 Allowed Pre-proline 0 CA--C 1.536 0.404 0 C-N-CA 122.913 0.485 . . . . 0.0 110.416 -179.969 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_exo -57.45 127.64 26.28 Favored 'Trans proline' 0 N--CA 1.448 -1.186 0 C-N-CA 122.525 2.15 . . . . 0.0 110.214 179.053 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 17.3 m -79.9 53.77 1.73 Allowed 'General case' 0 CA--C 1.53 0.202 0 N-CA-C 110.387 -0.227 . . . . 0.0 110.387 -179.186 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -69.18 -44.73 71.6 Favored 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 179.345 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 53.3 t -70.4 -30.47 43.13 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.204 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 179.313 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 56.27 51.78 11.15 Favored 'General case' 0 C--N 1.345 0.412 0 C-N-CA 122.869 0.468 . . . . 0.0 110.087 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 10.6 tpt85 -155.83 -138.6 0.07 Allowed 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 179.708 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 58.1 p -158.49 128.25 5.83 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 -179.714 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 5.5 tt -62.45 -41.46 98.76 Favored 'General case' 0 CA--C 1.531 0.223 0 N-CA-C 110.221 -0.288 . . . . 0.0 110.221 -179.536 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 22.1 mmmt 56.21 73.83 0.42 Allowed 'General case' 0 C--N 1.347 0.46 0 C-N-CA 122.919 0.488 . . . . 0.0 110.327 179.775 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 8.8 p . . . . . 0 C--O 1.254 1.313 0 CA-C-O 117.117 -1.421 . . . . 0.0 109.704 179.113 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.7 mpt? . . . . . 0 N--CA 1.472 0.663 0 N-CA-C 110.037 -0.357 . . . . 0.0 110.037 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -84.74 69.61 10.7 Favored 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 179.53 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 22.9 p -138.36 163.43 31.87 Favored 'General case' 0 CA--C 1.519 -0.212 0 CA-C-O 121.077 0.465 . . . . 0.0 110.497 -179.412 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -58.0 -29.62 36.71 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.406 0 CA-C-N 115.336 -0.847 . . . . 0.0 109.774 176.594 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 28.9 mtpp -58.51 -64.92 0.75 Allowed 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 122.492 0.317 . . . . 0.0 110.757 -178.763 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -58.9 -44.85 91.28 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.64 -0.254 . . . . 0.0 110.623 -179.379 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 53.5 t -56.53 -45.2 82.07 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 179.577 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.6 -45.09 91.92 Favored 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 110.397 -0.224 . . . . 0.0 110.397 -179.74 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 34.9 mtmm -58.55 -41.49 85.71 Favored 'General case' 0 C--N 1.341 0.237 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 178.512 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.43 -35.23 76.98 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 108.748 -0.834 . . . . 0.0 108.748 177.911 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -88.58 15.64 7.76 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.471 178.458 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 64.2 t30 85.26 145.91 0.06 Allowed 'General case' 0 C--N 1.353 0.738 0 C-N-CA 124.281 1.032 . . . . 0.0 111.487 177.74 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 4.9 t 65.24 -116.6 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.471 0 CA-C-N 114.907 -1.042 . . . . 0.0 109.814 178.461 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 7.9 t -166.25 -161.69 0.49 Allowed 'General case' 0 C--N 1.344 0.341 0 CA-C-N 118.491 0.587 . . . . 0.0 110.247 -178.758 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 39.1 p -54.26 -23.32 14.41 Favored 'General case' 0 C--N 1.342 0.261 0 C-N-CA 123.189 0.596 . . . . 0.0 111.744 -177.881 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 13.2 t -56.2 -38.53 71.11 Favored 'General case' 0 C--O 1.222 -0.385 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 179.257 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 58.0 m -65.72 -35.32 80.42 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 109.922 -0.399 . . . . 0.0 109.922 179.767 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 62.3 t -69.98 -52.71 28.48 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.336 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 179.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 85.3 p -53.42 -40.31 65.02 Favored 'General case' 0 C--N 1.343 0.298 0 N-CA-C 110.524 -0.176 . . . . 0.0 110.524 -178.634 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 57.7 m170 -54.05 -36.41 63.04 Favored 'General case' 0 C--N 1.345 0.386 0 C-N-CA 122.27 0.228 . . . . 0.0 110.396 179.112 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 59.2 t -78.49 -35.02 18.57 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.224 0 CA-C-N 116.687 -0.233 . . . . 0.0 110.397 -179.288 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 25.5 mm -67.23 -50.84 59.4 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.218 0 CA-C-N 117.889 0.313 . . . . 0.0 110.214 -179.285 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 34.6 p30 -87.27 -8.67 56.52 Favored 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 111.674 0.25 . . . . 0.0 111.674 -177.645 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 54.25 36.75 25.84 Favored 'General case' 0 C--N 1.345 0.399 0 C-N-CA 122.616 0.367 . . . . 0.0 110.388 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 7.0 t -82.12 -30.1 31.34 Favored 'General case' 0 CA--C 1.531 0.247 0 N-CA-C 110.307 -0.257 . . . . 0.0 110.307 -179.291 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 60.1 mtp85 -128.31 116.95 20.61 Favored 'General case' 0 C--N 1.344 0.344 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 47.4 t80 -71.72 108.38 5.02 Favored 'General case' 0 N--CA 1.453 -0.285 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 -179.668 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 4.6 m -107.35 38.55 0.37 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.376 0 C-N-CA 122.551 0.341 . . . . 0.0 110.549 -178.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 60.73 -179.91 0.1 Allowed 'General case' 0 C--N 1.343 0.302 0 CA-C-O 121.111 0.482 . . . . 0.0 111.179 178.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 58.1 mm-40 -77.77 -25.64 49.23 Favored 'General case' 0 C--O 1.223 -0.298 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.286 179.693 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -58.3 -64.92 0.75 Allowed 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 110.471 -0.196 . . . . 0.0 110.471 -178.666 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 2.2 m -61.26 -44.29 97.48 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 110.091 -0.337 . . . . 0.0 110.091 -178.674 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 44.1 ttm105 -53.54 -55.8 22.49 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 122.826 0.451 . . . . 0.0 110.613 -179.336 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -63.36 -48.03 79.65 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 122.424 0.289 . . . . 0.0 110.496 -178.873 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.65 -47.32 70.46 Favored 'General case' 0 C--N 1.34 0.157 0 C-N-CA 122.187 0.195 . . . . 0.0 110.674 -178.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 37.9 t -62.78 -57.41 12.16 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.223 0 N-CA-C 110.173 -0.306 . . . . 0.0 110.173 -179.484 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 13.1 m95 -56.57 -32.13 64.89 Favored 'General case' 0 C--N 1.343 0.283 0 CA-C-N 117.463 0.119 . . . . 0.0 110.946 -178.235 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -71.59 -67.48 0.52 Allowed 'General case' 0 N--CA 1.447 -0.581 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 179.075 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -48.08 -40.54 23.58 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 122.692 0.397 . . . . 0.0 111.555 -178.11 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 1.5 mm -44.71 -54.4 1.23 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.206 0 C-N-CA 123.095 0.558 . . . . 0.0 111.27 -178.326 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 24.3 pttm -100.84 -31.78 10.99 Favored 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 112.187 0.44 . . . . 0.0 112.187 -176.112 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 76.1 mm-40 -73.5 -40.19 64.25 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 118.04 0.382 . . . . 0.0 110.989 -176.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.0 tt -77.33 -36.43 53.93 Favored 'General case' 0 CA--C 1.527 0.084 0 N-CA-C 110.179 -0.304 . . . . 0.0 110.179 -178.688 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 15.2 m80 76.93 134.28 0.06 Allowed 'General case' 0 C--N 1.346 0.444 0 C-N-CA 123.619 0.768 . . . . 0.0 109.735 -178.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 3.7 p90 -146.91 152.27 38.41 Favored 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 178.301 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 1.7 m -49.18 -65.66 0.77 Allowed Pre-proline 0 CA--C 1.543 0.691 0 CA-C-O 118.543 -0.741 . . . . 0.0 112.581 -174.735 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 17.5 Cg_endo -69.63 72.73 1.36 Allowed 'Trans proline' 0 C--N 1.359 1.11 0 C-N-CA 122.225 1.95 . . . . 0.0 111.049 -179.605 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 22.3 t -137.8 146.17 43.22 Favored 'General case' 0 N--CA 1.455 -0.193 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 179.887 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -73.52 -45.09 55.79 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.31 -179.513 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 8.9 t -81.53 63.39 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.294 0 N-CA-C 109.806 -0.442 . . . . 0.0 109.806 -178.653 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -83.88 52.75 2.36 Favored 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 178.853 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 12.3 mmm180 -113.69 -38.65 4.23 Favored 'General case' 0 C--N 1.34 0.192 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 -178.956 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 41.4 m -77.08 66.96 2.98 Favored 'General case' 0 N--CA 1.455 -0.187 0 N-CA-C 109.973 -0.38 . . . . 0.0 109.973 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 28.0 mt -70.19 -49.21 52.59 Favored 'General case' 0 N--CA 1.455 -0.187 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 -179.897 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -158.08 160.81 37.77 Favored 'General case' 0 N--CA 1.452 -0.326 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 179.633 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 58.4 t . . . . . 0 C--O 1.249 1.028 0 CA-C-O 116.586 -1.673 . . . . 0.0 109.625 -179.318 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.8 tmt? . . . . . 0 N--CA 1.471 0.598 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -162.2 155.86 21.01 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 179.621 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.1 p -107.95 157.4 18.24 Favored 'General case' 0 N--CA 1.453 -0.275 0 C-N-CA 122.684 0.394 . . . . 0.0 110.145 -178.837 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -59.43 -28.28 39.33 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.286 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.246 -179.691 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 58.2 mtmt -48.43 -63.05 1.19 Allowed 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 122.947 0.499 . . . . 0.0 110.583 179.41 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -58.38 -44.97 89.15 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.722 -178.45 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 97.1 t -57.12 -43.34 81.27 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.184 0 N-CA-C 110.319 -0.252 . . . . 0.0 110.319 -179.168 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.71 -40.08 93.78 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 122.386 0.275 . . . . 0.0 110.715 -178.702 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -64.65 -49.32 71.47 Favored 'General case' 0 C--O 1.227 -0.125 0 N-CA-C 109.521 -0.548 . . . . 0.0 109.521 179.447 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.38 -31.76 73.1 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.258 179.844 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -71.41 -53.22 14.79 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 122.241 0.216 . . . . 0.0 110.635 -178.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 42.7 t30 -147.94 -82.65 0.12 Allowed 'General case' 0 C--N 1.342 0.264 0 CA-C-O 119.682 -0.199 . . . . 0.0 111.06 -177.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 95.2 t -140.68 -66.87 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.348 0.514 0 CA-C-N 117.68 0.218 . . . . 0.0 110.911 -176.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 74.4 m -132.43 172.48 12.42 Favored 'General case' 0 C--N 1.344 0.365 0 CA-C-O 120.995 0.426 . . . . 0.0 110.892 -176.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 43.0 p -53.91 -31.72 51.04 Favored 'General case' 0 C--O 1.223 -0.314 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.438 -178.696 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 12.8 t -49.4 -44.8 45.45 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 122.099 0.159 . . . . 0.0 110.936 -178.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 6.6 m -57.52 -28.83 63.82 Favored 'General case' 0 C--N 1.342 0.281 0 CA-C-O 119.687 -0.197 . . . . 0.0 111.116 -178.756 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 40.2 t -88.33 -37.08 9.99 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.223 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 179.098 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 25.4 m -57.08 -45.86 82.97 Favored 'General case' 0 CA--C 1.519 -0.233 0 C-N-CA 122.474 0.31 . . . . 0.0 110.473 -177.347 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 52.9 m-70 -56.13 -43.16 77.93 Favored 'General case' 0 C--O 1.209 -1.064 0 N-CA-C 110.177 -0.305 . . . . 0.0 110.177 -179.497 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 3.2 t -58.27 -29.5 37.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 O-C-N 121.9 -0.5 . . . . 0.0 112.325 -176.204 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 2.7 mt -79.85 -29.41 12.89 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.462 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 -176.239 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 6.4 p30 -117.37 -33.7 4.54 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 118.613 0.642 . . . . 0.0 112.168 -175.488 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 174.08 102.9 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 -177.521 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 65.5 p -48.83 -33.34 10.32 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 112.722 0.638 . . . . 0.0 112.722 -177.609 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 74.68 -164.0 0.08 Allowed 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 -177.148 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.1 t80 -79.24 96.14 5.84 Favored 'General case' 0 CA--C 1.531 0.232 0 O-C-N 122.249 -0.282 . . . . 0.0 110.779 -178.209 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 1.6 m -149.22 151.21 13.2 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.236 0 N-CA-C 108.576 -0.898 . . . . 0.0 108.576 176.9 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.88 153.66 42.99 Favored 'General case' 0 N--CA 1.447 -0.605 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 178.855 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 38.3 mp0 -55.21 -34.09 63.64 Favored 'General case' 0 CA--C 1.527 0.088 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 179.589 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -53.84 -41.84 67.84 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 122.66 0.384 . . . . 0.0 110.804 -179.857 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 1.7 m -66.22 -22.73 66.35 Favored 'General case' 0 C--N 1.346 0.432 0 N-CA-C 110.234 -0.284 . . . . 0.0 110.234 -178.202 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 3.0 mmp_? -85.07 -47.03 10.59 Favored 'General case' 0 C--N 1.343 0.312 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 179.762 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 28.2 m120 -54.19 -43.66 70.91 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 179.51 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -58.02 -41.61 83.51 Favored 'General case' 0 N--CA 1.453 -0.307 0 O-C-N 123.165 0.291 . . . . 0.0 111.317 -179.523 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 38.4 t -66.16 -57.17 11.5 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.195 0 CA-C-N 117.609 0.186 . . . . 0.0 110.551 -177.919 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 33.9 m95 -65.45 -30.77 71.6 Favored 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 110.719 -0.104 . . . . 0.0 110.719 -177.315 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -67.24 -51.12 57.05 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 177.505 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.23 -41.55 84.36 Favored 'General case' 0 C--N 1.342 0.266 0 C-N-CA 122.362 0.265 . . . . 0.0 110.334 179.74 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 3.2 mm -54.39 -50.82 54.53 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.272 0 C-N-CA 122.788 0.435 . . . . 0.0 110.315 179.782 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 20.4 tptm -74.11 -33.16 63.49 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 110.243 -0.28 . . . . 0.0 110.243 -178.014 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -63.96 -63.35 1.18 Allowed 'General case' 0 N--CA 1.448 -0.539 0 C-N-CA 122.368 0.267 . . . . 0.0 110.947 -177.61 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 82.3 mt -83.49 -20.79 33.32 Favored 'General case' 0 C--N 1.338 0.088 0 CA-C-O 119.47 -0.3 . . . . 0.0 111.503 -176.768 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 73.87 138.47 0.06 Allowed 'General case' 0 C--N 1.345 0.407 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 -178.279 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 8.7 t80 -125.21 142.01 51.75 Favored 'General case' 0 C--N 1.333 -0.126 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 179.487 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 1.7 t -105.77 111.15 64.69 Favored Pre-proline 0 CA--C 1.539 0.535 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 179.049 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 8.6 Cg_endo -68.67 -172.59 0.48 Allowed 'Trans proline' 0 N--CA 1.453 -0.856 0 C-N-CA 122.526 2.151 . . . . 0.0 110.821 -179.753 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 15.4 m -47.53 -42.16 22.75 Favored 'General case' 0 C--N 1.346 0.441 0 N-CA-C 109.941 -0.392 . . . . 0.0 109.941 178.892 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -76.58 84.75 3.26 Favored 'General case' 0 N--CA 1.449 -0.498 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 176.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 86.5 t -48.49 120.35 0.84 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.175 0 C-N-CA 122.748 0.419 . . . . 0.0 110.083 -178.461 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -77.69 70.51 4.07 Favored 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 179.781 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 20.7 tpt180 -58.68 -33.09 69.75 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 122.617 0.367 . . . . 0.0 110.305 -179.633 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 22.8 t -62.67 -31.38 72.26 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 122.295 0.238 . . . . 0.0 110.384 179.869 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 73.4 mt 55.39 -105.07 0.25 Allowed 'General case' 0 C--N 1.347 0.459 0 C-N-CA 122.907 0.483 . . . . 0.0 109.886 -179.309 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 39.5 ttmt -159.65 143.55 14.66 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 61.7 t . . . . . 0 C--O 1.254 1.293 0 CA-C-O 116.541 -1.695 . . . . 0.0 108.838 179.637 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.2 tmt? . . . . . 0 N--CA 1.472 0.642 0 N-CA-C 110.02 -0.363 . . . . 0.0 110.02 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -161.1 59.18 0.3 Allowed 'General case' 0 C--N 1.341 0.235 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 179.598 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 40.2 p -124.27 -178.58 4.14 Favored 'General case' 0 CA--C 1.517 -0.309 0 CA-C-O 121.385 0.612 . . . . 0.0 110.306 -179.792 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 33.9 pt -57.35 -25.02 22.77 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.776 0 CA-C-N 115.033 -0.985 . . . . 0.0 109.673 176.265 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 36.5 mtpt -65.71 -63.11 1.17 Allowed 'General case' 0 N--CA 1.448 -0.536 0 N-CA-C 109.549 -0.537 . . . . 0.0 109.549 179.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -49.41 -49.83 43.19 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.447 178.843 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 64.4 t -58.78 -51.75 68.33 Favored 'Isoleucine or valine' 0 C--N 1.341 0.224 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.299 -179.239 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -55.6 -54.56 42.62 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 122.28 0.232 . . . . 0.0 110.64 -178.726 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 61.9 mtpt -58.83 -38.85 79.61 Favored 'General case' 0 N--CA 1.453 -0.283 0 O-C-N 123.113 0.258 . . . . 0.0 110.457 -178.371 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 14.1 tpt180 -63.41 -36.82 84.98 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 177.701 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -82.75 7.86 13.83 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 122.417 0.287 . . . . 0.0 110.241 177.862 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 76.53 -35.79 0.25 Allowed 'General case' 0 C--N 1.35 0.591 0 C-N-CA 124.144 0.977 . . . . 0.0 111.888 177.823 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -78.05 -170.99 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 CA-C-N 118.321 0.509 . . . . 0.0 110.384 -178.003 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 11.2 t -102.93 179.78 4.18 Favored 'General case' 0 C--N 1.345 0.372 0 C-N-CA 122.824 0.45 . . . . 0.0 110.439 -178.468 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 19.4 p -58.02 -29.21 65.14 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 123.106 0.562 . . . . 0.0 111.644 -177.372 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 12.5 t -53.91 -38.23 64.62 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 117.814 0.279 . . . . 0.0 110.667 -179.298 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 87.2 m -67.4 -36.68 81.78 Favored 'General case' 0 N--CA 1.451 -0.393 0 O-C-N 122.168 -0.332 . . . . 0.0 110.152 -179.361 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 66.7 t -73.96 -41.02 53.0 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 N-CA-C 109.931 -0.396 . . . . 0.0 109.931 -179.62 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 94.0 p -59.88 -41.31 91.28 Favored 'General case' 0 N--CA 1.453 -0.278 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 179.021 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 55.2 m170 -56.5 -35.45 68.03 Favored 'General case' 0 C--N 1.346 0.436 0 N-CA-C 110.085 -0.339 . . . . 0.0 110.085 177.827 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 99.4 t -72.94 -57.79 6.27 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.162 0 C-N-CA 122.376 0.27 . . . . 0.0 110.68 -177.714 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 34.2 mm -57.0 -48.46 81.69 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.157 0 N-CA-C 110.368 -0.234 . . . . 0.0 110.368 -177.509 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 34.9 m-80 -73.8 -28.86 61.85 Favored 'General case' 0 CA--C 1.53 0.192 0 N-CA-C 110.496 -0.187 . . . . 0.0 110.496 -179.27 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 34.3 ttpt 57.01 53.72 7.72 Favored 'General case' 0 C--N 1.344 0.327 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 -179.124 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 13.9 t -108.46 -43.3 4.35 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.849 -177.432 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 27.0 tpt180 -85.54 109.66 18.67 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 109.408 -0.59 . . . . 0.0 109.408 -179.013 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 66.4 t80 -64.64 144.68 57.05 Favored 'General case' 0 N--CA 1.456 -0.149 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.268 -179.802 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 5.5 m -147.81 -171.05 0.25 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 -179.567 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -85.53 28.89 0.72 Allowed 'General case' 0 CA--C 1.539 0.526 0 CA-C-O 119.621 -0.228 . . . . 0.0 111.322 -179.325 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 72.56 -65.64 0.34 Allowed 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 123.427 0.691 . . . . 0.0 111.564 178.086 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -42.76 -47.13 5.39 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.355 0.662 . . . . 0.0 111.599 -176.872 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 6.6 m -50.48 -39.95 49.62 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 122.426 0.29 . . . . 0.0 111.026 -179.195 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 3.4 mpt_? -82.38 -42.45 18.64 Favored 'General case' 0 N--CA 1.46 0.058 0 N-CA-C 109.992 -0.373 . . . . 0.0 109.992 -178.789 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 20.2 t30 -54.41 -43.45 71.5 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 110.014 -0.365 . . . . 0.0 110.014 179.364 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -56.98 -49.0 77.09 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 122.537 0.335 . . . . 0.0 110.272 179.858 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 84.8 t -62.85 -49.28 84.28 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 N-CA-C 109.824 -0.436 . . . . 0.0 109.824 179.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 18.4 m95 -53.84 -40.27 66.31 Favored 'General case' 0 C--N 1.341 0.236 0 N-CA-C 110.05 -0.352 . . . . 0.0 110.05 179.767 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -66.55 -47.59 72.36 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 178.41 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -53.75 -39.57 65.45 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 122.425 0.29 . . . . 0.0 110.974 -179.482 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 1.1 mp -53.69 -39.75 39.84 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.384 0 N-CA-C 110.231 -0.285 . . . . 0.0 110.231 179.792 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 57.4 tptt -86.71 -40.25 15.23 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 122.244 0.218 . . . . 0.0 110.744 -177.328 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 47.2 mm-40 -61.68 -51.8 66.94 Favored 'General case' 0 N--CA 1.456 -0.175 0 N-CA-C 110.04 -0.355 . . . . 0.0 110.04 -177.696 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 61.3 tp -83.78 -82.54 0.16 Allowed 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 179.571 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 2.5 p-80 161.8 145.31 0.01 OUTLIER 'General case' 0 C--N 1.345 0.372 0 C-N-CA 124.24 1.016 . . . . 0.0 108.589 -179.835 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 29.5 t80 -161.6 147.49 13.85 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 178.887 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 46.9 t -118.16 88.88 33.62 Favored Pre-proline 0 CA--C 1.534 0.363 0 C-N-CA 122.565 0.346 . . . . 0.0 110.233 -178.819 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo -64.3 -53.78 1.02 Allowed 'Trans proline' 0 N--CA 1.447 -1.22 0 C-N-CA 122.433 2.088 . . . . 0.0 110.13 178.619 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 43.3 t -161.99 150.22 14.94 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 109.298 -0.63 . . . . 0.0 109.298 -179.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -72.22 -42.69 65.44 Favored 'General case' 0 N--CA 1.451 -0.387 0 N-CA-C 109.619 -0.511 . . . . 0.0 109.619 179.39 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 28.1 t 68.3 149.03 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.349 0.547 0 C-N-CA 123.682 0.793 . . . . 0.0 110.281 -179.909 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -78.13 71.76 4.62 Favored 'General case' 0 N--CA 1.454 -0.225 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 179.6 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 80.2 mtt-85 -78.22 63.94 3.25 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 109.893 -0.41 . . . . 0.0 109.893 -179.428 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 77.4 p -84.82 -176.23 6.12 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 109.546 -0.539 . . . . 0.0 109.546 179.533 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 11.2 tp 56.43 72.54 0.49 Allowed 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 122.719 0.408 . . . . 0.0 109.935 179.612 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 4.8 mptp? -73.53 128.21 34.87 Favored 'General case' 0 N--CA 1.454 -0.262 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 179.694 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 95.2 t . . . . . 0 C--O 1.252 1.22 0 CA-C-O 116.818 -1.563 . . . . 0.0 108.764 179.515 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 72.3 mtm . . . . . 0 N--CA 1.472 0.663 0 N-CA-C 110.027 -0.361 . . . . 0.0 110.027 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -62.52 153.64 31.16 Favored 'General case' 0 C--O 1.235 0.298 0 N-CA-C 110.051 -0.351 . . . . 0.0 110.051 179.917 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 18.4 p -111.03 175.4 5.43 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 20.2 tt -56.69 -31.77 35.89 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.304 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 179.4 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 9.0 mtmp? -59.75 -65.84 0.61 Allowed 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 122.575 0.35 . . . . 0.0 110.125 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -54.96 -51.3 66.61 Favored 'General case' 0 N--CA 1.456 -0.147 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.513 -178.698 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 55.0 t -55.99 -49.86 72.92 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 C-N-CA 122.658 0.383 . . . . 0.0 110.643 -178.196 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.0 -50.47 70.61 Favored 'General case' 0 N--CA 1.456 -0.168 0 C-N-CA 122.175 0.19 . . . . 0.0 111.186 -177.743 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 41.9 tttm -62.08 -36.03 80.46 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 122.071 0.149 . . . . 0.0 110.624 -178.024 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 21.7 tpp180 -72.44 -41.25 66.36 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 109.754 -0.462 . . . . 0.0 109.754 179.588 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -64.89 -57.42 8.85 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 122.541 0.337 . . . . 0.0 111.129 -178.384 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 22.1 m120 -135.74 -121.36 0.16 Allowed 'General case' 0 C--N 1.342 0.253 0 N-CA-C 110.299 -0.26 . . . . 0.0 110.299 -177.22 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 94.5 t -87.69 -58.8 3.17 Favored 'Isoleucine or valine' 0 C--N 1.342 0.266 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 -178.351 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 52.4 p -167.48 -164.04 0.56 Allowed 'General case' 0 C--O 1.232 0.155 0 N-CA-C 109.912 -0.403 . . . . 0.0 109.912 -179.06 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 27.9 m -56.88 -27.39 60.45 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.557 179.914 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 23.5 p -59.79 -54.56 44.81 Favored 'General case' 0 C--N 1.341 0.236 0 N-CA-C 110.068 -0.345 . . . . 0.0 110.068 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -62.57 -20.91 65.17 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-O 119.52 -0.276 . . . . 0.0 111.084 -179.337 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 39.4 t -82.04 -53.27 12.29 Favored 'Isoleucine or valine' 0 C--N 1.34 0.178 0 CA-C-N 118.028 0.377 . . . . 0.0 110.035 179.272 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 84.2 p -50.87 -38.42 49.35 Favored 'General case' 0 C--N 1.342 0.268 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 -179.325 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 58.1 m170 -50.22 -39.82 45.58 Favored 'General case' 0 CA--C 1.529 0.166 0 O-C-N 123.266 0.353 . . . . 0.0 110.227 178.344 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 3.7 t -84.81 -53.97 9.65 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.167 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.032 -178.679 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 31.6 mm -55.22 -50.33 65.25 Favored 'Isoleucine or valine' 0 C--N 1.343 0.307 0 O-C-N 122.797 0.061 . . . . 0.0 110.918 -175.788 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 25.5 t30 -82.42 -3.2 55.21 Favored 'General case' 0 CA--C 1.533 0.305 0 N-CA-C 110.175 -0.306 . . . . 0.0 110.175 -178.498 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 52.8 mtmt 55.19 37.82 29.48 Favored 'General case' 0 C--N 1.347 0.466 0 N-CA-C 108.839 -0.801 . . . . 0.0 108.839 -178.294 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.9 -32.47 73.74 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 115.567 -0.742 . . . . 0.0 109.885 -178.877 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 15.6 ptp180 -157.48 145.05 18.69 Favored 'General case' 0 N--CA 1.452 -0.362 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 179.007 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 30.8 t80 -79.66 92.12 5.33 Favored 'General case' 0 N--CA 1.455 -0.214 0 N-CA-C 109.752 -0.462 . . . . 0.0 109.752 -178.812 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 11.7 m -72.75 163.58 3.88 Favored 'Isoleucine or valine' 0 C--O 1.233 0.22 0 N-CA-C 109.92 -0.4 . . . . 0.0 109.92 178.845 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -65.35 157.03 30.32 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 178.142 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -53.92 -38.02 64.42 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 122.575 0.35 . . . . 0.0 110.415 -179.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -68.14 -12.4 60.84 Favored 'General case' 0 CA--C 1.538 0.518 0 N-CA-C 112.172 0.434 . . . . 0.0 112.172 -177.432 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -94.67 -52.31 4.34 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 118.343 0.52 . . . . 0.0 109.9 179.546 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 6.6 ptm180 -69.45 -35.28 75.49 Favored 'General case' 0 CA--C 1.53 0.2 0 N-CA-C 112.02 0.378 . . . . 0.0 112.02 -176.645 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 43.2 p-10 -57.59 -38.62 75.2 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 118.202 0.456 . . . . 0.0 110.162 -179.214 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.41 -43.09 91.64 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 110.32 -0.252 . . . . 0.0 110.32 -179.86 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 87.4 t -60.51 -59.66 3.81 Favored 'Isoleucine or valine' 0 C--N 1.339 0.15 0 N-CA-C 110.105 -0.332 . . . . 0.0 110.105 -179.466 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 52.5 m95 -60.47 -37.28 80.52 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 116.718 -0.219 . . . . 0.0 110.942 -177.549 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -63.49 -58.2 7.77 Favored 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 178.895 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -52.39 -45.17 65.71 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 122.304 0.242 . . . . 0.0 110.766 -178.745 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 36.1 mt -54.7 -30.13 21.98 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 C-N-CA 122.245 0.218 . . . . 0.0 111.041 -179.437 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 7.7 mtpm? -85.11 -53.61 5.16 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 110.047 -0.353 . . . . 0.0 110.047 -178.676 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -63.98 -55.86 19.32 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.657 -175.425 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -73.87 -3.23 27.56 Favored 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 179.556 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 37.0 p-80 40.62 84.18 0.02 OUTLIER 'General case' 0 C--N 1.353 0.741 0 C-N-CA 124.036 0.934 . . . . 0.0 111.556 179.291 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 13.3 t80 -56.69 108.12 0.46 Allowed 'General case' 0 N--CA 1.456 -0.154 0 CA-C-N 115.527 -0.76 . . . . 0.0 109.166 178.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 30.5 t -165.65 85.13 1.01 Allowed Pre-proline 0 N--CA 1.451 -0.396 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 -179.028 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 3.5 Cg_exo -62.97 120.47 7.97 Favored 'Trans proline' 0 N--CA 1.447 -1.245 0 C-N-CA 122.639 2.226 . . . . 0.0 110.663 -179.906 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 11.5 p -74.42 -43.32 56.82 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 178.313 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -88.58 -171.01 3.16 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 178.782 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 12.2 p 42.01 40.91 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.789 0 C-N-CA 123.524 0.73 . . . . 0.0 110.872 179.643 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -95.85 -55.44 2.99 Favored 'General case' 0 C--N 1.341 0.234 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 179.718 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 4.8 ppt_? -66.8 -27.85 67.9 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 116.587 -0.279 . . . . 0.0 110.436 179.698 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 49.5 m -78.84 130.6 35.87 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 109.341 -0.615 . . . . 0.0 109.341 179.538 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -74.22 88.74 2.0 Allowed 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 -179.647 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 30.4 tptt -148.69 124.63 10.63 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 179.643 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 27.7 m . . . . . 0 C--O 1.25 1.081 0 CA-C-O 116.317 -1.801 . . . . 0.0 108.714 178.348 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.5 tmm? . . . . . 0 N--CA 1.472 0.664 0 N-CA-C 110.034 -0.358 . . . . 0.0 110.034 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -67.26 96.69 0.49 Allowed 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 109.727 -0.472 . . . . 0.0 109.727 179.344 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 21.8 p -142.42 -77.89 0.25 Allowed 'General case' 0 N--CA 1.452 -0.353 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 -179.852 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 19.5 tt -140.44 -32.77 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.174 0 C-N-CA 123.009 0.524 . . . . 0.0 109.707 178.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 26.7 mmtp -67.35 -62.96 1.17 Allowed 'General case' 0 N--CA 1.445 -0.69 0 C-N-CA 122.785 0.434 . . . . 0.0 110.962 -179.425 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 65.7 m-20 -69.04 -42.83 75.82 Favored 'General case' 0 N--CA 1.461 0.105 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.798 -175.764 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 18.7 m -53.31 -56.6 7.55 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.191 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 -179.905 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -59.12 -45.88 89.78 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 122.988 0.515 . . . . 0.0 110.857 179.419 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 2.0 ttmp? -53.57 -49.74 67.05 Favored 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 110.178 -0.305 . . . . 0.0 110.178 -179.101 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 57.6 ttt85 -71.67 -37.81 70.72 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 122.371 0.268 . . . . 0.0 110.645 -179.007 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -60.53 -40.17 90.55 Favored 'General case' 0 N--CA 1.456 -0.168 0 C-N-CA 122.257 0.223 . . . . 0.0 110.793 -178.595 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 23.8 t-20 -140.79 -88.36 0.17 Allowed 'General case' 0 C--N 1.343 0.325 0 N-CA-C 110.461 -0.2 . . . . 0.0 110.461 -179.418 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 71.5 t -139.47 -57.35 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.345 0.38 0 N-CA-C 109.835 -0.432 . . . . 0.0 109.835 -178.266 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 67.1 m -152.44 176.34 11.77 Favored 'General case' 0 C--N 1.344 0.339 0 N-CA-C 109.872 -0.418 . . . . 0.0 109.872 -179.342 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 17.2 p -63.52 -20.59 65.74 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.103 -179.637 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 14.9 t -53.79 -38.82 64.89 Favored 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 109.999 -0.371 . . . . 0.0 109.999 179.601 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 18.0 m -61.47 -42.47 98.83 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 109.819 -0.438 . . . . 0.0 109.819 179.463 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 20.6 t -65.72 -35.63 75.65 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.14 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 179.356 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 23.1 t -65.28 -43.59 90.69 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 72.7 m-70 -64.16 -43.22 95.85 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.285 179.38 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 16.2 t -55.72 -47.17 79.58 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.28 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 179.123 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 60.3 mt -61.63 -48.46 88.66 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 29.4 m-80 -75.28 -9.97 59.04 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 122.167 0.187 . . . . 0.0 111.119 -179.245 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 4.8 tmtp? 62.38 42.97 8.51 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 122.893 0.477 . . . . 0.0 110.012 -179.881 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -98.24 -84.4 0.39 Allowed 'General case' 0 C--N 1.344 0.357 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 179.762 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 67.1 mtp180 -97.11 120.5 37.58 Favored 'General case' 0 N--CA 1.456 -0.126 0 N-CA-C 109.496 -0.557 . . . . 0.0 109.496 -179.792 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 29.2 p90 -149.77 120.78 7.7 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 179.234 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 3.8 t -81.76 75.97 0.96 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.396 0 N-CA-C 107.856 -1.164 . . . . 0.0 107.856 179.048 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 65.11 -178.89 0.18 Allowed 'General case' 0 C--O 1.236 0.348 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.094 -178.352 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 -65.29 -25.1 67.49 Favored 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 110.214 -0.291 . . . . 0.0 110.214 -179.197 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -52.09 -39.13 59.31 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 122.565 0.346 . . . . 0.0 110.813 179.438 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 99.0 m -59.07 -67.41 0.37 Allowed 'General case' 0 C--N 1.343 0.287 0 N-CA-C 110.439 -0.208 . . . . 0.0 110.439 -179.581 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 9.9 ptm180 -56.5 -39.13 72.77 Favored 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 110.581 -0.155 . . . . 0.0 110.581 -177.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -59.7 -57.39 13.12 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 110.305 -0.257 . . . . 0.0 110.305 -179.443 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -59.81 -42.25 93.06 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 122.429 0.292 . . . . 0.0 110.649 -179.102 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 21.3 t -58.39 -61.13 1.5 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.2 0 C-N-CA 122.365 0.266 . . . . 0.0 110.324 -179.216 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 19.5 m95 -61.63 -38.22 86.86 Favored 'General case' 0 N--CA 1.455 -0.177 0 N-CA-C 110.687 -0.116 . . . . 0.0 110.687 -178.145 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -59.65 -51.42 69.89 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 109.863 -0.421 . . . . 0.0 109.863 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -61.38 -46.94 88.1 Favored 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 122.29 0.236 . . . . 0.0 110.64 -179.38 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 55.5 mt -58.18 -41.83 81.82 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.295 0 C-N-CA 122.229 0.211 . . . . 0.0 110.496 -179.22 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 37.6 ttmt -74.2 -38.81 63.5 Favored 'General case' 0 N--CA 1.45 -0.449 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 -178.067 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -62.66 -52.83 61.78 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-N 116.564 -0.289 . . . . 0.0 110.455 -178.153 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 10.2 mp -79.24 -18.16 53.38 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-O 119.554 -0.26 . . . . 0.0 110.47 -179.061 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 22.2 m80 76.17 137.62 0.06 Allowed 'General case' 0 C--N 1.348 0.509 0 C-N-CA 123.871 0.868 . . . . 0.0 110.966 178.299 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 8.1 t80 -110.34 101.27 10.02 Favored 'General case' 0 CA--C 1.529 0.158 0 N-CA-C 108.466 -0.939 . . . . 0.0 108.466 178.729 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' SER . . . . . 0.414 ' CB ' ' HD3' ' A' ' 47' ' ' PRO . 1.1 m -60.22 -64.7 2.74 Favored Pre-proline 0 CA--C 1.544 0.724 0 CA-C-O 118.691 -0.671 . . . . 0.0 111.061 -177.587 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . 0.414 ' HD3' ' CB ' ' A' ' 46' ' ' SER . 8.6 Cg_exo -54.18 148.75 39.06 Favored 'Trans proline' 0 C--N 1.36 1.16 0 C-N-CA 121.856 1.704 . . . . 0.0 110.757 178.368 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 20.9 t -69.19 168.35 14.28 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 116.482 -0.327 . . . . 0.0 110.695 -178.819 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -60.33 -52.21 66.23 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-N 116.234 -0.439 . . . . 0.0 109.95 179.761 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 33.0 m -91.29 143.6 10.91 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.241 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 179.793 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -72.38 -48.19 43.57 Favored 'General case' 0 N--CA 1.455 -0.178 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 179.435 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 37.2 ttp85 -153.53 50.52 0.69 Allowed 'General case' 0 CA--C 1.531 0.218 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 179.688 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 27.2 m 49.88 47.42 23.17 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 122.68 0.392 . . . . 0.0 110.257 -179.796 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -66.46 -52.7 43.44 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 -179.571 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 56.8 mtpt 55.5 -121.22 1.68 Allowed 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 109.57 -0.53 . . . . 0.0 109.57 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 14.2 p . . . . . 0 C--O 1.251 1.149 0 CA-C-O 116.776 -1.583 . . . . 0.0 108.968 179.954 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.0 mpp? . . . . . 0 N--CA 1.479 1.021 0 N-CA-C 109.869 -0.419 . . . . 0.0 109.869 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -163.53 -79.12 0.03 OUTLIER 'General case' 0 C--N 1.345 0.37 0 CA-C-O 119.788 -0.149 . . . . 0.0 110.644 179.274 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 3.9 t 178.01 -42.52 0.01 OUTLIER 'General case' 0 C--N 1.349 0.545 0 C-N-CA 122.601 0.361 . . . . 0.0 110.244 -176.988 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 7.1 tt -146.34 -20.56 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.85 0 N-CA-C 111.836 0.31 . . . . 0.0 111.836 -177.956 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 15.6 tppt? -48.01 -70.26 0.1 Allowed 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 123.552 0.741 . . . . 0.0 112.293 -178.11 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 69.1 m-20 -63.07 -40.19 96.95 Favored 'General case' 0 C--O 1.221 -0.399 0 CA-C-O 119.787 -0.149 . . . . 0.0 110.711 -175.579 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.4 t -52.17 -46.35 43.86 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.175 0 C-N-CA 122.166 0.187 . . . . 0.0 110.785 -179.111 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -52.61 -61.36 2.33 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 110.584 -0.154 . . . . 0.0 110.584 -178.578 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -68.38 -28.21 66.91 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-O 119.791 -0.147 . . . . 0.0 111.347 -177.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 1.6 tpm_? -62.01 -48.0 82.23 Favored 'General case' 0 C--N 1.339 0.146 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 179.212 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -78.49 -1.07 32.01 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 110.068 -0.345 . . . . 0.0 110.068 178.033 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 7.7 t-20 61.13 48.06 6.67 Favored 'General case' 0 C--N 1.348 0.501 0 C-N-CA 123.613 0.765 . . . . 0.0 110.828 178.8 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 30.3 m -146.43 148.01 17.45 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.221 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 177.671 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 69.2 m -63.91 154.76 32.85 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 109.762 -0.459 . . . . 0.0 109.762 179.604 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 15.0 t -53.81 -32.72 53.76 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 116.576 -0.283 . . . . 0.0 110.364 179.484 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 3.7 m -57.07 -43.0 81.66 Favored 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 178.891 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 6.1 m -63.06 -40.79 98.72 Favored 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 179.527 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 47.1 t -64.05 -39.05 84.07 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.238 0 N-CA-C 109.333 -0.618 . . . . 0.0 109.333 179.417 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 10.0 t -55.99 -37.64 69.38 Favored 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 110.129 -0.323 . . . . 0.0 110.129 179.337 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 43.0 m170 -61.27 -33.61 73.83 Favored 'General case' 0 C--N 1.341 0.237 0 N-CA-C 110.261 -0.274 . . . . 0.0 110.261 179.704 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 90.8 t -74.56 -41.41 48.8 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.099 0 C-N-CA 122.182 0.193 . . . . 0.0 110.886 -178.969 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 72.4 mt -49.23 -55.05 4.52 Favored 'Isoleucine or valine' 0 C--N 1.343 0.298 0 C-N-CA 122.297 0.239 . . . . 0.0 110.958 -176.828 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 5.8 p30 -104.8 13.31 31.51 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 117.558 0.163 . . . . 0.0 110.825 -178.36 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 65.1 mttt 46.9 58.57 4.63 Favored 'General case' 0 C--N 1.346 0.421 0 C-N-CA 122.829 0.452 . . . . 0.0 110.64 179.268 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -72.49 -65.98 0.72 Allowed 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 -179.528 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 84.1 mtt85 -94.04 129.06 40.7 Favored 'General case' 0 C--N 1.342 0.274 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 -179.608 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -77.14 111.12 12.41 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 109.37 -0.604 . . . . 0.0 109.37 179.942 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 9.5 m -110.03 43.31 0.27 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 CA-C-N 115.806 -0.633 . . . . 0.0 109.479 -178.881 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.457 ' C ' ' H ' ' A' ' 31' ' ' GLU . . . 54.79 22.69 4.34 Favored 'General case' 0 C--N 1.345 0.379 0 C-N-CA 123.565 0.746 . . . . 0.0 112.16 178.52 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 70.6 mm-40 65.82 -26.65 0.1 Allowed 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 124.052 0.941 . . . . 0.0 113.096 178.661 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.457 ' H ' ' C ' ' A' ' 29' ' ' ALA . 40.8 tt0 -48.11 -58.93 3.82 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 118.547 0.612 . . . . 0.0 110.879 -178.528 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 7.9 m -64.64 -39.63 94.03 Favored 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 110.744 -0.095 . . . . 0.0 110.744 -178.512 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 92.2 mtt180 -57.97 -52.89 63.63 Favored 'General case' 0 CA--C 1.533 0.299 0 N-CA-C 110.129 -0.323 . . . . 0.0 110.129 -179.327 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -63.72 -37.95 89.27 Favored 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 110.066 -0.346 . . . . 0.0 110.066 -179.232 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -60.63 -42.54 97.11 Favored 'General case' 0 C--N 1.341 0.205 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 179.051 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 20.6 t -65.59 -45.08 93.39 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 179.014 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 15.4 m95 -61.63 -33.75 74.47 Favored 'General case' 0 CA--C 1.531 0.244 0 N-CA-C 109.895 -0.409 . . . . 0.0 109.895 179.145 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -67.58 -42.96 81.7 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 109.033 -0.728 . . . . 0.0 109.033 177.365 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.64 -38.67 78.61 Favored 'General case' 0 C--N 1.345 0.393 0 N-CA-C 110.001 -0.37 . . . . 0.0 110.001 178.884 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -54.65 -44.88 71.65 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 179.367 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 15.0 mttm -94.99 12.55 28.05 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-O 119.655 -0.212 . . . . 0.0 111.313 -178.467 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -79.32 -48.86 13.36 Favored 'General case' 0 N--CA 1.456 -0.168 0 N-CA-C 108.647 -0.872 . . . . 0.0 108.647 178.917 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -92.99 -94.03 0.15 Allowed 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 178.709 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 99.7 m-70 -159.79 26.41 0.18 Allowed 'General case' 0 C--N 1.343 0.286 0 C-N-CA 123.232 0.613 . . . . 0.0 109.533 -178.322 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -80.84 153.36 27.71 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.989 0.423 . . . . 0.0 110.036 -177.931 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 22.2 p -167.21 76.6 1.01 Allowed Pre-proline 0 CA--C 1.536 0.412 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 -179.711 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -58.1 -47.38 20.46 Favored 'Trans proline' 0 N--CA 1.45 -1.067 0 C-N-CA 122.639 2.226 . . . . 0.0 111.024 -178.397 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 18.6 m -80.17 53.75 1.81 Allowed 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 110.229 -0.285 . . . . 0.0 110.229 -179.595 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -167.93 -56.01 0.02 OUTLIER 'General case' 0 N--CA 1.456 -0.174 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 179.625 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 9.9 p -65.34 128.51 28.24 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.27 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 -179.548 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -169.24 -58.55 0.02 OUTLIER 'General case' 0 C--N 1.342 0.242 0 N-CA-C 109.36 -0.607 . . . . 0.0 109.36 -179.674 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 44.4 ttm-85 57.63 45.87 18.45 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 122.787 0.435 . . . . 0.0 110.077 -179.829 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 16.6 m -70.46 139.4 51.72 Favored 'General case' 0 C--O 1.237 0.42 0 N-CA-C 109.765 -0.457 . . . . 0.0 109.765 179.772 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 2.3 pp -63.8 157.55 24.17 Favored 'General case' 0 C--N 1.341 0.229 0 N-CA-C 109.934 -0.395 . . . . 0.0 109.934 179.534 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 47.2 mmtt -95.59 -43.06 8.11 Favored 'General case' 0 CA--C 1.528 0.113 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 -178.829 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 14.6 p . . . . . 0 C--O 1.255 1.355 0 CA-C-O 116.495 -1.716 . . . . 0.0 108.997 179.686 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.474 0.773 0 CA-C-O 120.879 0.371 . . . . 0.0 110.683 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -79.07 63.92 3.86 Favored 'General case' 0 C--N 1.342 0.277 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 179.578 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 5.2 m -126.46 50.03 1.96 Allowed 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 108.52 -0.918 . . . . 0.0 108.52 -178.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER 80.53 -23.88 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.465 0 C-N-CA 124.484 1.114 . . . . 0.0 110.429 -179.688 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -66.97 -66.03 0.61 Allowed 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 122.568 0.347 . . . . 0.0 110.252 -179.812 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 91.3 m-20 -65.55 -39.0 91.23 Favored 'General case' 0 C--O 1.227 -0.084 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 84.7 t -55.52 -44.25 75.57 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.235 0 C-N-CA 122.673 0.389 . . . . 0.0 110.176 -179.487 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -57.6 -47.07 83.16 Favored 'General case' 0 C--N 1.34 0.187 0 C-N-CA 122.044 0.137 . . . . 0.0 110.707 -179.294 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 6.3 mmmm -67.09 -41.12 86.84 Favored 'General case' 0 N--CA 1.457 -0.089 0 N-CA-C 109.773 -0.454 . . . . 0.0 109.773 179.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 45.0 ttt85 -59.52 -35.79 74.86 Favored 'General case' 0 N--CA 1.452 -0.351 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 179.131 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -75.89 -56.93 4.2 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 110.029 -0.359 . . . . 0.0 110.029 179.556 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -164.15 -93.73 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 119.82 -0.133 . . . . 0.0 111.276 -179.151 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 5.0 m -97.94 -118.63 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 C-N-CA 122.232 0.213 . . . . 0.0 110.867 -176.248 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 89.5 p -105.98 -175.09 2.7 Favored 'General case' 0 C--N 1.344 0.36 0 C-N-CA 122.621 0.368 . . . . 0.0 110.327 -176.981 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 76.8 p -55.83 -23.83 32.81 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.215 -178.398 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 13.2 t -51.62 -44.83 63.05 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 117.724 0.238 . . . . 0.0 110.426 -179.898 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 2.4 m -64.92 -47.91 76.04 Favored 'General case' 0 C--N 1.341 0.219 0 N-CA-C 110.301 -0.259 . . . . 0.0 110.301 -179.453 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 54.6 t -58.4 -44.84 89.52 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.169 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 -179.47 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 56.3 m -60.91 -45.81 93.18 Favored 'General case' 0 C--O 1.22 -0.496 0 N-CA-C 110.013 -0.365 . . . . 0.0 110.013 179.489 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 34.7 m170 -58.31 -41.58 84.78 Favored 'General case' 0 C--N 1.339 0.148 0 N-CA-C 110.292 -0.262 . . . . 0.0 110.292 -179.608 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 42.4 t -65.88 -55.93 17.17 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.257 0 O-C-N 123.085 0.241 . . . . 0.0 110.688 -178.939 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 92.6 mt -64.02 -53.34 45.12 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 N-CA-C 110.299 -0.26 . . . . 0.0 110.299 -177.69 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 19.4 t-20 -62.32 -30.66 71.31 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 122.624 0.37 . . . . 0.0 110.581 -179.237 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 41.2 tttp 71.45 53.09 0.23 Allowed 'General case' 0 C--N 1.344 0.342 0 C-N-CA 122.915 0.486 . . . . 0.0 109.735 179.816 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 26.6 p -75.71 -64.57 1.05 Allowed 'General case' 0 C--N 1.34 0.154 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 179.39 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 48.6 ttp85 -128.89 134.23 48.2 Favored 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 179.629 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 54.6 p90 -64.85 143.19 58.11 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 179.749 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 30.1 m -110.27 170.42 3.28 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.147 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 179.529 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -80.3 51.35 1.4 Allowed 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 122.402 0.281 . . . . 0.0 111.213 -177.728 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 63.79 -68.68 0.09 Allowed 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.249 1.02 . . . . 0.0 112.746 177.835 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 56.5 mm-40 -37.4 -53.5 1.12 Allowed 'General case' 0 C--N 1.34 0.162 0 C-N-CA 123.729 0.812 . . . . 0.0 112.076 -175.042 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 8.2 m -60.05 -52.04 67.07 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 116.983 -0.098 . . . . 0.0 111.015 -177.47 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 11.8 ttp85 -60.89 -47.47 86.24 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 122.26 0.224 . . . . 0.0 110.64 -178.58 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 20.5 m-80 -61.69 -41.18 97.22 Favored 'General case' 0 N--CA 1.456 -0.158 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 -179.788 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -60.79 -40.62 93.3 Favored 'General case' 0 C--N 1.34 0.185 0 N-CA-C 110.158 -0.312 . . . . 0.0 110.158 179.852 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 38.0 t -64.09 -53.79 39.39 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.199 0 N-CA-C 109.6 -0.518 . . . . 0.0 109.6 179.439 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 13.5 m95 -59.82 -33.92 72.39 Favored 'General case' 0 C--O 1.233 0.229 0 N-CA-C 110.615 -0.143 . . . . 0.0 110.615 -179.202 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -70.37 -57.85 4.38 Favored 'General case' 0 C--O 1.224 -0.286 0 N-CA-C 109.789 -0.449 . . . . 0.0 109.789 179.401 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -50.09 -44.19 51.81 Favored 'General case' 0 C--N 1.341 0.203 0 C-N-CA 122.94 0.496 . . . . 0.0 111.066 -179.082 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 13.8 mt -51.36 -40.92 24.62 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 C-N-CA 122.977 0.511 . . . . 0.0 111.046 -179.36 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 41.2 mttp -98.03 -20.0 17.66 Favored 'General case' 0 C--N 1.344 0.328 0 N-CA-C 111.567 0.21 . . . . 0.0 111.567 -177.13 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -73.17 -50.04 24.8 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 109.106 -0.702 . . . . 0.0 109.106 -178.089 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 51.6 tp -77.64 -92.0 0.03 OUTLIER 'General case' 0 N--CA 1.446 -0.642 0 N-CA-C 108.153 -1.054 . . . . 0.0 108.153 177.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 4.0 p-80 165.3 75.87 0.0 OUTLIER 'General case' 0 C--N 1.341 0.233 0 C-N-CA 123.759 0.824 . . . . 0.0 108.996 179.781 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 15.6 t80 -70.0 136.78 50.78 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.118 -0.492 . . . . 0.0 109.776 -179.411 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 19.9 p -117.96 96.59 49.81 Favored Pre-proline 0 CA--C 1.537 0.446 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 178.814 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 10.9 Cg_endo -71.96 72.78 2.6 Favored 'Trans proline' 0 N--CA 1.449 -1.092 0 C-N-CA 122.68 2.253 . . . . 0.0 110.184 179.031 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 19.5 m -60.01 -35.34 74.85 Favored 'General case' 0 CA--C 1.529 0.14 0 C-N-CA 122.442 0.297 . . . . 0.0 110.271 -179.827 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -57.02 -38.43 73.12 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 122.455 0.302 . . . . 0.0 110.405 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 11.2 t -128.77 65.56 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.342 0.262 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 -179.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -75.06 -63.85 1.18 Allowed 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 109.554 -0.536 . . . . 0.0 109.554 179.74 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 18.9 ttm180 -165.07 -141.27 0.05 OUTLIER 'General case' 0 N--CA 1.451 -0.379 0 N-CA-C 108.532 -0.914 . . . . 0.0 108.532 179.312 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 42.7 t -103.24 -52.05 3.11 Favored 'General case' 0 C--N 1.338 0.077 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 -179.897 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -94.65 -171.52 2.5 Favored 'General case' 0 CA--C 1.536 0.409 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 -179.722 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 4.4 ttpt -68.35 -38.5 81.53 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 122.417 0.287 . . . . 0.0 110.693 -178.398 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 33.0 t . . . . . 0 C--O 1.25 1.099 0 CA-C-O 117.292 -1.337 . . . . 0.0 109.98 -178.981 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.478 0.974 0 CA-C-O 119.693 -0.194 . . . . 0.0 111.4 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -53.57 -77.93 0.02 OUTLIER 'General case' 0 C--N 1.352 0.69 0 N-CA-C 110.203 -0.295 . . . . 0.0 110.203 -179.276 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' THR . . . . . 0.423 ' C ' ' H ' ' A' ' 5' ' ' LYS . 3.2 m 64.23 167.75 0.16 Allowed 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 122.667 0.387 . . . . 0.0 110.686 177.564 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER 77.75 -40.79 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.528 0 C-N-CA 124.228 1.011 . . . . 0.0 108.734 -177.856 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.423 ' H ' ' C ' ' A' ' 3' ' ' THR . 62.9 mttp -69.68 -60.97 1.98 Allowed 'General case' 0 N--CA 1.446 -0.64 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 177.586 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -63.91 -51.49 64.25 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 115.683 -0.69 . . . . 0.0 109.502 178.619 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 76.5 t -45.65 -47.1 4.79 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.225 0 C-N-CA 123.121 0.569 . . . . 0.0 111.707 -177.399 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -53.86 -62.46 1.64 Allowed 'General case' 0 C--O 1.223 -0.313 0 CA-C-N 117.511 0.142 . . . . 0.0 111.333 -177.78 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 21.7 mmmt -68.45 -44.11 75.6 Favored 'General case' 0 C--N 1.331 -0.232 0 O-C-N 122.45 -0.156 . . . . 0.0 110.988 -176.874 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 16.3 tpp180 -57.82 -39.82 78.52 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 122.568 0.347 . . . . 0.0 110.7 -178.467 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -98.22 12.86 33.26 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-O 119.562 -0.256 . . . . 0.0 110.825 -179.384 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . 0.495 ' O ' ' CG2' ' A' ' 13' ' ' VAL . 48.6 t30 75.52 150.83 0.12 Allowed 'General case' 0 C--N 1.35 0.589 0 C-N-CA 123.684 0.793 . . . . 0.0 110.147 179.945 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.495 ' CG2' ' O ' ' A' ' 12' ' ' ASN . 2.2 m 82.94 175.1 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.479 0.982 0 C-N-CA 125.679 1.591 . . . . 0.0 110.315 -179.609 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 22.4 t -96.91 -178.06 4.09 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.501 -177.623 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 19.1 p -69.0 -45.17 71.25 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.383 -179.048 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 11.9 t -56.22 -41.93 76.45 Favored 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 110.46 -0.2 . . . . 0.0 110.46 -179.121 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -65.3 -28.28 69.21 Favored 'General case' 0 CA--C 1.53 0.202 0 O-C-N 122.24 -0.287 . . . . 0.0 110.34 179.893 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 65.8 t -76.59 -37.89 30.21 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.199 0 N-CA-C 108.496 -0.927 . . . . 0.0 108.496 176.707 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 19.6 m -58.71 -33.08 69.79 Favored 'General case' 0 CA--C 1.531 0.226 0 N-CA-C 109.989 -0.374 . . . . 0.0 109.989 178.521 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 51.4 m170 -56.13 -39.35 72.1 Favored 'General case' 0 C--N 1.345 0.381 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 178.398 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 56.4 t -68.02 -46.36 81.87 Favored 'Isoleucine or valine' 0 C--N 1.341 0.211 0 N-CA-C 109.786 -0.45 . . . . 0.0 109.786 179.66 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 72.7 mt -58.87 -39.57 77.82 Favored 'Isoleucine or valine' 0 C--O 1.234 0.253 0 N-CA-C 109.835 -0.431 . . . . 0.0 109.835 -179.236 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 34.5 m-80 -93.77 15.35 16.67 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 122.369 0.267 . . . . 0.0 110.282 179.436 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 30.15 65.39 0.14 Allowed 'General case' 0 C--N 1.356 0.868 0 C-N-CA 124.376 1.07 . . . . 0.0 111.566 -179.357 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 17.4 p -104.44 -83.7 0.49 Allowed 'General case' 0 C--N 1.342 0.24 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 178.208 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 14.4 tpt180 -90.81 105.29 17.72 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 108.936 -0.764 . . . . 0.0 108.936 179.212 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 40.7 t80 -78.26 100.45 6.69 Favored 'General case' 0 N--CA 1.454 -0.227 0 N-CA-C 109.705 -0.48 . . . . 0.0 109.705 -179.738 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 4.3 t -87.28 57.4 0.17 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.42 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 -179.917 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 65.26 176.25 0.21 Allowed 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 123.233 0.613 . . . . 0.0 111.489 178.933 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 48.1 mp0 -68.9 -25.74 64.75 Favored 'General case' 0 C--O 1.219 -0.509 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.009 -179.273 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 20.6 tp10 -53.81 -60.26 3.55 Favored 'General case' 0 C--O 1.226 -0.165 0 C-N-CA 122.559 0.344 . . . . 0.0 111.263 -176.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 63.1 p -61.83 -44.75 96.21 Favored 'General case' 0 C--O 1.224 -0.272 0 N-CA-C 110.003 -0.369 . . . . 0.0 110.003 -178.555 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 64.7 ttp85 -56.37 -60.19 3.87 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 122.41 0.284 . . . . 0.0 111.284 -178.192 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -67.01 -39.91 87.17 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-O 119.603 -0.236 . . . . 0.0 111.08 -175.231 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -62.8 -45.13 94.06 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 117.881 0.309 . . . . 0.0 110.409 -179.777 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 20.3 t -60.63 -57.25 12.82 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.108 0 C-N-CA 122.299 0.24 . . . . 0.0 110.646 -178.802 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 14.9 m95 -60.14 -38.04 81.89 Favored 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 110.77 -0.085 . . . . 0.0 110.77 -178.151 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -63.25 -53.23 56.28 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 -179.933 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -60.3 -40.49 90.72 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-N 116.569 -0.287 . . . . 0.0 110.636 -179.139 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 14.3 mt -59.53 -44.53 93.27 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.146 0 N-CA-C 110.232 -0.284 . . . . 0.0 110.232 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 57.8 tptt -70.27 -35.28 73.65 Favored 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 -178.59 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -66.74 -52.87 39.27 Favored 'General case' 0 N--CA 1.443 -0.798 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.041 -177.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 10.5 mp -81.78 -21.05 38.0 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 122.348 0.259 . . . . 0.0 111.305 -177.456 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 2.4 m-70 71.73 110.66 0.06 Allowed 'General case' 0 N--CA 1.465 0.317 0 N-CA-C 108.636 -0.876 . . . . 0.0 108.636 -177.032 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -103.78 108.36 19.63 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 122.83 0.452 . . . . 0.0 110.387 -176.522 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 55.8 p -89.53 116.73 67.08 Favored Pre-proline 0 CA--C 1.536 0.425 0 N-CA-C 108.323 -0.992 . . . . 0.0 108.323 176.753 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -70.68 79.26 1.25 Allowed 'Trans proline' 0 N--CA 1.452 -0.917 0 C-N-CA 122.313 2.009 . . . . 0.0 110.903 -178.434 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 23.3 t 48.14 45.86 19.65 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 122.813 0.445 . . . . 0.0 110.69 178.873 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -154.0 95.21 1.83 Allowed 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 109.743 -0.466 . . . . 0.0 109.743 -179.43 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 33.9 m -69.04 152.46 9.48 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.231 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 179.466 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -153.0 84.73 1.21 Allowed 'General case' 0 N--CA 1.453 -0.317 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 -179.777 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 42.9 ttt85 57.98 42.75 22.28 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 -179.357 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 27.8 p -79.26 71.26 5.78 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 179.658 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 72.2 mt -75.33 77.84 2.42 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 -179.739 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 47.0 mtmt 63.35 46.2 4.54 Favored 'General case' 0 C--N 1.342 0.267 0 C-N-CA 123.154 0.582 . . . . 0.0 109.949 -179.622 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 76.6 t . . . . . 0 C--O 1.248 0.984 0 CA-C-O 116.833 -1.556 . . . . 0.0 108.645 179.03 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 18.7 mmt . . . . . 0 N--CA 1.473 0.683 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -165.15 -171.94 2.37 Favored 'General case' 0 C--N 1.341 0.203 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 -179.592 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -135.01 -53.08 0.79 Allowed 'General case' 0 C--O 1.223 -0.336 0 N-CA-C 109.712 -0.477 . . . . 0.0 109.712 179.669 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 14.8 tt -177.19 -35.52 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.344 0.33 0 O-C-N 123.667 0.605 . . . . 0.0 109.802 -178.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 22.3 mtmm -48.33 -68.55 0.17 Allowed 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 123.657 0.783 . . . . 0.0 111.849 -177.587 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -52.23 -58.46 6.57 Favored 'General case' 0 C--O 1.219 -0.504 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.073 -177.667 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 63.1 t -50.22 -42.4 20.17 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.398 0 O-C-N 123.001 0.188 . . . . 0.0 111.197 -176.434 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -53.38 -62.86 1.38 Allowed 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 112.019 0.377 . . . . 0.0 112.019 -177.024 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 19.0 mtpp -79.1 -38.33 36.47 Favored 'General case' 0 N--CA 1.461 0.12 0 N-CA-C 110.618 -0.142 . . . . 0.0 110.618 -176.088 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 57.5 ttm-85 -57.6 -35.26 70.2 Favored 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 179.197 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -76.36 -60.82 2.17 Favored 'General case' 0 C--N 1.347 0.463 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 177.288 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 179.99 131.0 0.1 Allowed 'General case' 0 C--N 1.347 0.461 0 CA-C-O 120.686 0.279 . . . . 0.0 111.295 179.641 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 37.8 t 52.18 -94.52 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 C-N-CA 123.788 0.835 . . . . 0.0 111.497 176.31 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 66.9 m -149.96 -178.31 6.41 Favored 'General case' 0 C--N 1.344 0.364 0 CA-C-O 120.777 0.322 . . . . 0.0 110.368 -177.479 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 10.0 m -53.2 -35.26 59.68 Favored 'General case' 0 C--O 1.224 -0.259 0 C-N-CA 123.161 0.585 . . . . 0.0 110.975 -178.803 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 17.1 p -51.71 -46.86 64.1 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 122.46 0.304 . . . . 0.0 110.425 -179.29 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 24.9 m -65.62 -48.42 72.3 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 110.327 -0.249 . . . . 0.0 110.327 -178.907 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 87.5 t -60.38 -35.1 60.46 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.35 0 N-CA-C 110.242 -0.281 . . . . 0.0 110.242 -179.439 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 7.7 t -59.48 -45.06 92.72 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 109.983 -0.377 . . . . 0.0 109.983 -179.609 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 80.6 m-70 -58.49 -40.11 81.87 Favored 'General case' 0 N--CA 1.456 -0.135 0 O-C-N 122.996 0.185 . . . . 0.0 110.695 -179.021 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 52.9 t -56.27 -52.7 48.44 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.153 0 N-CA-C 110.003 -0.369 . . . . 0.0 110.003 -179.599 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 78.4 mt -66.04 -42.5 91.7 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 -179.415 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 37.8 t-20 -66.02 -20.92 66.34 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 122.973 0.509 . . . . 0.0 110.608 -179.545 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 74.3 tttt 66.24 50.98 1.29 Allowed 'General case' 0 C--N 1.343 0.289 0 C-N-CA 122.952 0.501 . . . . 0.0 109.655 -179.607 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -97.95 -82.89 0.41 Allowed 'General case' 0 C--N 1.341 0.212 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 179.665 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 19.0 ptp180 -87.36 154.17 20.89 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 179.792 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 50.5 t80 -123.83 145.39 49.11 Favored 'General case' 0 N--CA 1.456 -0.151 0 N-CA-C 109.886 -0.413 . . . . 0.0 109.886 -179.729 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 2.9 t -134.97 172.87 15.35 Favored 'Isoleucine or valine' 0 C--O 1.231 0.114 0 N-CA-C 107.828 -1.175 . . . . 0.0 107.828 179.198 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -48.08 149.52 1.41 Allowed 'General case' 0 C--O 1.235 0.331 0 N-CA-C 110.142 -0.318 . . . . 0.0 110.142 179.051 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 22.2 mp0 -51.3 -28.37 11.89 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.681 -179.225 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -57.02 -47.91 79.74 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 122.216 0.206 . . . . 0.0 110.499 179.624 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 10.4 m -64.82 -49.7 69.58 Favored 'General case' 0 C--N 1.344 0.359 0 N-CA-C 110.189 -0.3 . . . . 0.0 110.189 -178.74 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 38.4 mmt-85 -55.84 -50.64 70.0 Favored 'General case' 0 N--CA 1.455 -0.206 0 N-CA-C 109.785 -0.45 . . . . 0.0 109.785 -179.557 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -59.0 -48.49 81.38 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 122.552 0.341 . . . . 0.0 110.379 -179.613 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -57.83 -45.2 86.53 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 122.121 0.168 . . . . 0.0 110.678 -178.934 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 54.6 t -60.28 -57.24 12.73 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 N-CA-C 110.243 -0.28 . . . . 0.0 110.243 -178.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 41.4 m95 -60.63 -40.26 91.25 Favored 'General case' 0 CA--C 1.53 0.183 0 N-CA-C 110.735 -0.098 . . . . 0.0 110.735 -178.434 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -60.29 -53.14 61.24 Favored 'General case' 0 N--CA 1.453 -0.278 0 N-CA-C 109.722 -0.473 . . . . 0.0 109.722 179.69 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -56.41 -45.19 80.79 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 122.316 0.246 . . . . 0.0 110.493 -179.632 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 31.1 mt -56.18 -36.9 47.34 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.472 0 C-N-CA 122.256 0.223 . . . . 0.0 110.694 -179.314 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 6.3 mptp? -80.23 -45.6 17.71 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 -178.587 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 24.1 mm-40 -58.29 -47.4 83.78 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 122.48 0.312 . . . . 0.0 110.964 -178.052 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 6.0 mp -80.67 -1.8 44.01 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-O 119.611 -0.233 . . . . 0.0 110.777 -178.691 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 4.7 m-70 60.05 32.0 20.84 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 122.873 0.469 . . . . 0.0 110.905 178.454 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 10.2 t80 -61.79 135.26 57.52 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.438 -0.579 . . . . 0.0 109.438 179.237 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 40.3 t -159.39 118.78 1.69 Allowed Pre-proline 0 CA--C 1.533 0.294 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 -179.893 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 15.5 Cg_endo -72.93 71.17 3.48 Favored 'Trans proline' 0 N--CA 1.45 -1.03 0 C-N-CA 122.751 2.301 . . . . 0.0 109.864 179.219 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 10.6 p -80.18 -57.19 3.73 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 -179.226 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -81.26 51.17 1.56 Allowed 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 110.252 -0.277 . . . . 0.0 110.252 -179.81 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 11.8 p -73.76 95.74 0.8 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.417 0 N-CA-C 109.754 -0.462 . . . . 0.0 109.754 -179.529 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 57.17 42.18 25.96 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.624 179.953 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 15.4 ptm180 -158.21 38.25 0.25 Allowed 'General case' 0 CA--C 1.532 0.288 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 179.021 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 14.7 m -63.83 118.32 8.19 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 -179.724 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 69.6 tp -65.47 121.93 16.02 Favored 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -139.63 -51.71 0.52 Allowed 'General case' 0 C--N 1.34 0.177 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 179.655 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 58.1 t . . . . . 0 C--O 1.252 1.211 0 CA-C-O 116.706 -1.616 . . . . 0.0 108.707 179.654 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.3 ptt? . . . . . 0 N--CA 1.472 0.651 0 N-CA-C 110.133 -0.321 . . . . 0.0 110.133 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 60.43 -173.91 0.12 Allowed 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 123.047 0.539 . . . . 0.0 110.651 -179.978 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 2.1 m 84.51 -176.75 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 124.2 1.0 . . . . 0.0 109.326 177.272 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 19.8 tt -49.06 -29.17 2.93 Favored 'Isoleucine or valine' 0 C--N 1.342 0.254 0 C-N-CA 122.525 0.33 . . . . 0.0 110.149 179.507 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 45.0 mtpt -57.01 -60.14 4.03 Favored 'General case' 0 N--CA 1.446 -0.625 0 C-N-CA 122.699 0.399 . . . . 0.0 110.475 179.059 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -70.19 -42.64 72.12 Favored 'General case' 0 N--CA 1.458 -0.068 0 N-CA-C 110.168 -0.308 . . . . 0.0 110.168 -177.683 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 54.8 t -55.01 -47.74 76.58 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.166 0 N-CA-C 110.188 -0.301 . . . . 0.0 110.188 -179.408 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -58.16 -54.98 40.86 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 122.349 0.26 . . . . 0.0 110.864 -178.455 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 27.0 tttt -65.79 -27.39 68.24 Favored 'General case' 0 CA--C 1.531 0.247 0 O-C-N 122.808 0.068 . . . . 0.0 110.908 -177.931 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.95 -36.22 69.82 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 177.759 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -78.19 -41.59 34.1 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.264 -178.427 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -155.12 -147.67 0.21 Allowed 'General case' 0 N--CA 1.449 -0.504 0 CA-C-O 120.841 0.353 . . . . 0.0 110.727 -177.321 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 62.0 t -71.44 -54.39 17.43 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.501 0 C-N-CA 123.012 0.525 . . . . 0.0 110.336 -178.804 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 50.8 m -155.49 -179.05 7.73 Favored 'General case' 0 C--N 1.346 0.42 0 CA-C-O 121.007 0.432 . . . . 0.0 110.806 -177.806 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.8 m -66.98 -3.26 6.67 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.158 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 16.6 p -57.83 -56.09 26.48 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 179.132 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -60.29 -33.86 72.95 Favored 'General case' 0 CA--C 1.537 0.442 0 N-CA-C 110.265 -0.272 . . . . 0.0 110.265 -179.268 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 58.1 t -64.51 -46.74 91.82 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.222 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 179.269 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 20.6 m -60.26 -43.28 96.28 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 178.753 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 48.5 m170 -58.19 -43.3 87.48 Favored 'General case' 0 C--O 1.221 -0.414 0 N-CA-C 109.867 -0.419 . . . . 0.0 109.867 179.357 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 7.3 t -68.2 -39.61 81.46 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 C-N-CA 122.351 0.26 . . . . 0.0 111.155 -179.045 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 40.3 mt -60.04 -59.14 4.48 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.395 0 CA-C-O 119.424 -0.322 . . . . 0.0 111.789 -176.521 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 2.4 p-10 -114.14 22.12 14.13 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-N 118.235 0.47 . . . . 0.0 112.1 -175.644 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 29.6 ttpt 55.22 46.04 24.58 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 122.313 0.245 . . . . 0.0 110.774 177.96 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -66.93 -35.33 79.75 Favored 'General case' 0 C--N 1.341 0.203 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 179.088 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 9.7 tpt180 -142.08 143.08 32.9 Favored 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 -179.89 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 63.8 t80 -68.03 137.11 54.8 Favored 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 -179.903 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 10.5 m -141.49 153.76 19.81 Favored 'Isoleucine or valine' 0 C--O 1.236 0.375 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 178.592 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -66.11 159.43 26.18 Favored 'General case' 0 N--CA 1.45 -0.438 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 179.273 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -52.18 -41.82 62.96 Favored 'General case' 0 CA--C 1.529 0.135 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 179.641 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 51.2 mt-10 -52.19 -47.37 65.59 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 123.039 0.536 . . . . 0.0 111.075 -179.165 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -61.05 -46.96 88.57 Favored 'General case' 0 C--N 1.341 0.208 0 N-CA-C 110.104 -0.332 . . . . 0.0 110.104 -178.704 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 27.6 ttm105 -58.43 -53.68 55.62 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.338 -178.875 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 29.2 m120 -60.68 -46.1 91.62 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 116.676 -0.238 . . . . 0.0 110.54 -179.275 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -56.63 -47.92 78.66 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 122.428 0.291 . . . . 0.0 110.782 -178.555 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 24.5 t -58.92 -56.64 15.55 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.196 0 N-CA-C 110.319 -0.252 . . . . 0.0 110.319 -179.108 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 20.6 m95 -59.91 -36.39 76.89 Favored 'General case' 0 C--N 1.341 0.201 0 O-C-N 122.568 -0.083 . . . . 0.0 110.888 -178.537 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -65.42 -51.65 58.8 Favored 'General case' 0 N--CA 1.456 -0.172 0 N-CA-C 110.051 -0.352 . . . . 0.0 110.051 179.894 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -57.51 -43.13 83.97 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 122.615 0.366 . . . . 0.0 110.776 -179.026 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 33.0 mt -56.85 -42.67 78.53 Favored 'Isoleucine or valine' 0 C--N 1.34 0.196 0 C-N-CA 122.205 0.202 . . . . 0.0 110.496 -179.447 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 37.0 mtmm -76.82 -36.49 56.87 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 110.024 -0.361 . . . . 0.0 110.024 -179.168 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -60.89 -60.95 2.98 Favored 'General case' 0 N--CA 1.451 -0.402 0 O-C-N 123.259 0.35 . . . . 0.0 110.924 -178.27 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -81.09 -18.69 45.68 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-O 119.624 -0.227 . . . . 0.0 111.268 -177.5 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 5.1 m-70 76.18 128.48 0.04 OUTLIER 'General case' 0 C--N 1.344 0.346 0 C-N-CA 123.411 0.685 . . . . 0.0 109.701 -178.567 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 6.7 t80 -81.97 74.11 8.97 Favored 'General case' 0 C--O 1.218 -0.592 0 N-CA-C 108.404 -0.961 . . . . 0.0 108.404 178.168 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' SER . . . . . 0.515 ' CB ' ' CD ' ' A' ' 47' ' ' PRO . 9.6 m 8.38 -81.04 0.0 OUTLIER Pre-proline 0 CA--C 1.556 1.211 0 C-N-CA 125.34 1.456 . . . . 0.0 113.876 -178.326 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . 0.515 ' CD ' ' CB ' ' A' ' 46' ' ' SER . 6.2 Cg_endo -58.49 -60.02 0.42 Allowed 'Trans proline' 0 C--N 1.366 1.491 0 C-N-CA 121.847 1.698 . . . . 0.0 111.545 -179.044 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 50.8 m 63.28 175.97 0.16 Allowed 'General case' 0 C--N 1.345 0.408 0 C-N-CA 123.308 0.643 . . . . 0.0 110.512 -178.846 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -66.46 -36.66 83.33 Favored 'General case' 0 N--CA 1.455 -0.189 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 178.513 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 14.7 p -154.4 149.72 12.41 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.412 0 N-CA-C 108.696 -0.853 . . . . 0.0 108.696 179.138 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -148.68 -142.78 0.13 Allowed 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 109.009 -0.737 . . . . 0.0 109.009 -179.824 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 32.6 ptt-85 -165.46 -46.53 0.03 OUTLIER 'General case' 0 CA--C 1.529 0.173 0 N-CA-C 109.759 -0.46 . . . . 0.0 109.759 -179.826 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 12.3 p -174.01 -68.38 0.01 OUTLIER 'General case' 0 N--CA 1.455 -0.211 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 -179.902 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 64.19 -175.98 0.16 Allowed 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 122.885 0.474 . . . . 0.0 109.784 -179.476 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -162.74 162.5 26.76 Favored 'General case' 0 N--CA 1.456 -0.155 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 -179.667 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 58.0 t . . . . . 0 C--O 1.252 1.199 0 CA-C-O 116.133 -1.889 . . . . 0.0 108.914 178.885 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 51.3 ttp . . . . . 0 N--CA 1.471 0.614 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -70.72 176.36 4.26 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 110.069 -0.345 . . . . 0.0 110.069 -179.918 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.3 m -158.69 -46.92 0.06 Allowed 'General case' 0 C--O 1.224 -0.259 0 N-CA-C 109.861 -0.422 . . . . 0.0 109.861 -178.848 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.43 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 11.4 tt 159.07 -37.03 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 C-N-CA 125.173 1.389 . . . . 0.0 108.26 -179.323 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 67.0 mttm -61.11 -62.71 1.65 Allowed 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 123.428 0.691 . . . . 0.0 110.956 -178.114 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -51.94 -48.45 64.27 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.315 -178.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 10.9 t -65.01 -38.63 83.29 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.363 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.73 -177.705 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.25 -38.76 90.5 Favored 'General case' 0 CA--C 1.531 0.213 0 N-CA-C 110.414 -0.217 . . . . 0.0 110.414 -179.627 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 64.8 mmtt -73.47 -35.52 65.72 Favored 'General case' 0 CA--C 1.53 0.19 0 N-CA-C 110.121 -0.326 . . . . 0.0 110.121 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.59 -40.41 80.48 Favored 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 178.145 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -70.54 -48.55 54.9 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 123.024 0.53 . . . . 0.0 111.096 -178.585 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 4.6 t-20 -156.28 -137.16 0.06 Allowed 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 110.494 -0.187 . . . . 0.0 110.494 -178.017 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 87.4 t -92.5 -43.01 13.68 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.141 0 C-N-CA 122.873 0.469 . . . . 0.0 110.38 -177.668 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 27.0 t -152.46 167.44 28.75 Favored 'General case' 0 N--CA 1.453 -0.325 0 N-CA-C 110.068 -0.345 . . . . 0.0 110.068 -178.83 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 14.8 t -60.84 -27.75 68.31 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.201 -179.877 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 6.3 m -53.3 -54.14 40.71 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 122.555 0.342 . . . . 0.0 110.223 179.936 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 7.2 m -61.21 -45.45 94.51 Favored 'General case' 0 C--N 1.34 0.177 0 N-CA-C 110.25 -0.278 . . . . 0.0 110.25 -179.321 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 93.4 t -59.4 -38.1 73.18 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.231 0 N-CA-C 109.884 -0.413 . . . . 0.0 109.884 -179.7 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 21.0 t -65.87 -48.31 72.0 Favored 'General case' 0 N--CA 1.449 -0.495 0 N-CA-C 109.314 -0.625 . . . . 0.0 109.314 -179.611 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 59.4 m-70 -52.84 -47.27 67.84 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 110.572 -0.158 . . . . 0.0 110.572 -179.439 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 47.2 t -53.18 -49.95 48.82 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 N-CA-C 109.797 -0.446 . . . . 0.0 109.797 179.767 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 58.1 mt -64.63 -39.07 84.36 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 N-CA-C 110.1 -0.333 . . . . 0.0 110.1 -179.62 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 13.2 m120 -77.51 -4.99 48.44 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 122.22 0.208 . . . . 0.0 110.869 -179.476 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 93.4 mttt 57.33 49.95 12.32 Favored 'General case' 0 C--N 1.344 0.365 0 C-N-CA 122.917 0.487 . . . . 0.0 110.071 -179.701 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 1.1 p -109.63 -79.98 0.58 Allowed 'General case' 0 C--N 1.343 0.285 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 179.752 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 51.2 ttm-85 -72.1 96.6 1.79 Allowed 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 109.168 -0.678 . . . . 0.0 109.168 179.843 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 32.7 t80 -74.91 98.32 3.53 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 109.866 -0.42 . . . . 0.0 109.866 -179.157 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -85.15 177.55 0.59 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.373 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 178.712 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.5 159.38 29.78 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 178.326 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -57.25 -35.37 69.64 Favored 'General case' 0 N--CA 1.455 -0.214 0 N-CA-C 109.935 -0.394 . . . . 0.0 109.935 179.676 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 51.6 mt-10 -58.89 -51.57 69.46 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 122.355 0.262 . . . . 0.0 110.324 179.876 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.56 -43.02 81.66 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 110.067 -0.346 . . . . 0.0 110.067 -178.748 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 29.7 ttm105 -56.42 -51.25 69.07 Favored 'General case' 0 N--CA 1.454 -0.271 0 N-CA-C 110.055 -0.35 . . . . 0.0 110.055 179.902 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 88.7 m-20 -63.11 -45.3 92.66 Favored 'General case' 0 N--CA 1.456 -0.161 0 N-CA-C 110.09 -0.337 . . . . 0.0 110.09 -179.88 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -56.88 -41.87 78.81 Favored 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 110.509 -0.182 . . . . 0.0 110.509 -179.612 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 36.8 t -64.07 -54.58 29.71 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 N-CA-C 109.947 -0.39 . . . . 0.0 109.947 -179.676 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 29.6 m95 -56.91 -39.89 75.26 Favored 'General case' 0 C--N 1.34 0.19 0 N-CA-C 110.466 -0.198 . . . . 0.0 110.466 -179.316 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -65.03 -56.71 11.52 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 179.622 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -50.09 -45.15 52.41 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 123.062 0.545 . . . . 0.0 111.33 -179.001 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 26.0 mt -53.29 -44.2 53.01 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.233 0 C-N-CA 122.297 0.239 . . . . 0.0 110.703 -178.882 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 39.1 ttpt -81.05 -37.35 29.19 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 122.068 0.147 . . . . 0.0 110.61 -177.557 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 70.0 mt-10 -52.19 -58.33 6.93 Favored 'General case' 0 C--N 1.342 0.259 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 -179.083 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -75.92 -46.67 28.77 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 -179.665 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 69.43 130.98 0.03 OUTLIER 'General case' 0 C--N 1.347 0.48 0 C-N-CA 123.22 0.608 . . . . 0.0 109.718 -178.988 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.43 ' CE2' ' HA ' ' A' ' 4' ' ' ILE . 5.1 p90 -156.77 -139.1 0.07 Allowed 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 179.398 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 5.5 t -45.49 -45.81 33.58 Favored Pre-proline 0 CA--C 1.549 0.913 0 N-CA-C 113.505 0.928 . . . . 0.0 113.505 -177.195 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 4.0 Cg_exo -61.95 131.57 35.59 Favored 'Trans proline' 0 C--N 1.36 1.165 0 C-N-CA 121.375 1.383 . . . . 0.0 110.633 -178.95 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 10.9 m 63.62 23.44 13.56 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 123.155 0.582 . . . . 0.0 111.231 179.641 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -79.95 -17.91 51.79 Favored 'General case' 0 C--N 1.342 0.258 0 N-CA-C 110.119 -0.326 . . . . 0.0 110.119 178.499 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 22.0 t -74.61 78.04 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.286 0 N-CA-C 109.449 -0.575 . . . . 0.0 109.449 -179.578 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -159.52 -141.19 0.08 Allowed 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 108.577 -0.897 . . . . 0.0 108.577 179.556 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 51.8 mmm-85 -123.14 -63.69 1.23 Allowed 'General case' 0 C--N 1.339 0.113 0 N-CA-C 108.991 -0.744 . . . . 0.0 108.991 179.354 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 27.7 t -169.97 -63.14 0.02 OUTLIER 'General case' 0 N--CA 1.457 -0.121 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 179.574 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 60.26 33.33 20.96 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 -179.116 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 25.9 tptp -158.36 144.31 17.0 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 -179.787 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 27.6 m . . . . . 0 C--O 1.248 0.993 0 CA-C-O 116.955 -1.498 . . . . 0.0 109.144 179.044 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.475 0.801 0 CA-C-O 120.721 0.296 . . . . 0.0 110.318 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -161.71 -73.34 0.06 Allowed 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 109.195 -0.668 . . . . 0.0 109.195 -179.487 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' THR . . . . . 0.455 ' C ' ' H ' ' A' ' 5' ' ' LYS . 1.6 p 65.64 131.94 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 124.396 1.078 . . . . 0.0 111.311 178.136 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER 74.58 -35.32 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 C-N-CA 124.348 1.059 . . . . 0.0 110.253 179.026 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.455 ' H ' ' C ' ' A' ' 3' ' ' THR . 96.5 mttt -70.78 -59.36 2.85 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 123.075 0.55 . . . . 0.0 110.39 -178.552 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -45.37 -58.56 3.23 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.721 0.808 . . . . 0.0 111.314 -178.422 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 88.3 t -61.44 -47.1 94.99 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.151 0 C-N-CA 122.57 0.348 . . . . 0.0 110.794 -177.15 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -56.74 -44.47 81.73 Favored 'General case' 0 N--CA 1.455 -0.205 0 O-C-N 122.24 -0.288 . . . . 0.0 110.299 -179.548 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 53.0 mttp -72.4 -15.61 61.84 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-O 119.187 -0.435 . . . . 0.0 111.441 -177.887 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 8.6 tpm_? -59.3 -43.87 92.57 Favored 'General case' 0 C--N 1.343 0.297 0 N-CA-C 108.034 -1.098 . . . . 0.0 108.034 177.091 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -99.15 7.08 46.15 Favored 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 176.298 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 47.5 t30 70.74 -84.9 0.03 OUTLIER 'General case' 0 C--N 1.347 0.497 0 C-N-CA 124.519 1.127 . . . . 0.0 110.163 -179.442 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 2.7 t 29.44 -125.2 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.74 0 C-N-CA 124.518 1.127 . . . . 0.0 110.564 -177.845 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.459 ' C ' ' H ' ' A' ' 16' ' ' THR . 1.5 m -175.25 84.52 0.03 OUTLIER 'General case' 0 C--N 1.347 0.487 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 179.084 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.4 p 50.7 -2.5 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 125.252 1.421 . . . . 0.0 114.697 177.591 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.459 ' H ' ' C ' ' A' ' 14' ' ' SER . 0.8 OUTLIER -88.68 -42.47 11.96 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 118.54 0.609 . . . . 0.0 110.669 -177.947 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 13.2 t -51.41 -42.25 61.33 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 122.334 0.253 . . . . 0.0 111.361 -177.908 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 42.4 t -60.12 -54.82 29.5 Favored 'Isoleucine or valine' 0 C--O 1.232 0.134 0 N-CA-C 109.93 -0.396 . . . . 0.0 109.93 -179.076 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 19.7 m -60.0 -42.02 93.38 Favored 'General case' 0 C--O 1.222 -0.361 0 CA-C-N 116.67 -0.241 . . . . 0.0 110.613 -179.496 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 24.3 m170 -62.58 -43.92 97.61 Favored 'General case' 0 CA--C 1.528 0.123 0 C-N-CA 122.202 0.201 . . . . 0.0 110.579 -178.455 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 9.3 t -64.56 -49.61 79.74 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.187 0 C-N-CA 122.249 0.22 . . . . 0.0 110.613 -178.616 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 89.1 mt -65.9 -51.5 60.38 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.23 0 N-CA-C 110.044 -0.354 . . . . 0.0 110.044 -178.669 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 20.4 t-20 -63.88 -31.47 72.67 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 122.649 0.38 . . . . 0.0 111.016 -178.693 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 17.7 ttmt 67.13 40.34 2.88 Favored 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 -177.822 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 12.5 t -74.68 -29.48 61.24 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.331 -179.015 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 2.0 tmt_? -157.96 125.02 5.01 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 -179.423 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 46.4 p90 -59.08 147.87 33.24 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 110.026 -0.361 . . . . 0.0 110.026 -179.878 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -106.66 -173.05 0.42 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.327 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 -179.877 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -79.18 40.93 0.43 Allowed 'General case' 0 CA--C 1.536 0.44 0 O-C-N 122.353 -0.217 . . . . 0.0 111.493 -178.06 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 63.95 -74.58 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 123.347 0.659 . . . . 0.0 111.607 178.238 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -58.88 -35.06 72.38 Favored 'General case' 0 C--N 1.341 0.207 0 C-N-CA 122.5 0.32 . . . . 0.0 110.776 -177.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 8.9 m -61.06 -40.65 94.47 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 179.205 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 19.5 ttt180 -71.03 -43.03 68.7 Favored 'General case' 0 N--CA 1.454 -0.235 0 N-CA-C 109.689 -0.486 . . . . 0.0 109.689 179.383 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 35.0 t30 -58.07 -45.02 87.81 Favored 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 109.857 -0.423 . . . . 0.0 109.857 179.217 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -58.26 -42.58 86.77 Favored 'General case' 0 N--CA 1.456 -0.174 0 C-N-CA 122.541 0.337 . . . . 0.0 110.667 -179.505 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 25.6 t -62.67 -53.52 45.95 Favored 'Isoleucine or valine' 0 C--O 1.233 0.225 0 N-CA-C 109.924 -0.398 . . . . 0.0 109.924 -179.737 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 38.8 m95 -59.11 -39.97 83.94 Favored 'General case' 0 C--N 1.339 0.144 0 N-CA-C 110.487 -0.19 . . . . 0.0 110.487 -179.828 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -63.76 -52.32 60.94 Favored 'General case' 0 C--O 1.222 -0.369 0 N-CA-C 110.175 -0.306 . . . . 0.0 110.175 -179.459 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -56.07 -39.77 72.57 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 122.386 0.274 . . . . 0.0 111.334 -178.378 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 19.8 mt -53.34 -56.56 7.75 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 C-N-CA 122.219 0.208 . . . . 0.0 111.399 -177.617 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.3 -26.56 24.86 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 117.688 0.222 . . . . 0.0 111.473 -176.536 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -71.23 -47.71 55.65 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 117.875 0.307 . . . . 0.0 110.544 -178.195 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 79.1 mt -80.08 -14.59 58.4 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-O 119.389 -0.339 . . . . 0.0 110.939 -178.38 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . 0.431 ' C ' ' H ' ' A' ' 46' ' ' SER . 88.0 m-70 53.35 45.5 28.29 Favored 'General case' 0 C--N 1.348 0.514 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 -178.989 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -71.67 29.54 0.05 OUTLIER 'General case' 0 CA--C 1.547 0.827 0 CA-C-N 115.76 -0.655 . . . . 0.0 112.673 -177.295 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' SER . . . . . 0.431 ' H ' ' C ' ' A' ' 44' ' ' HIS . 49.2 p 42.75 79.0 0.35 Allowed Pre-proline 0 C--N 1.348 0.522 0 C-N-CA 123.573 0.749 . . . . 0.0 111.528 178.711 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_exo -60.45 149.84 84.23 Favored 'Trans proline' 0 N--CA 1.449 -1.142 0 C-N-CA 122.529 2.152 . . . . 0.0 110.155 178.75 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 16.0 m -54.56 -55.67 26.89 Favored 'General case' 0 C--N 1.34 0.161 0 N-CA-C 110.259 -0.274 . . . . 0.0 110.259 -179.638 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . 58.41 -91.26 0.03 OUTLIER 'General case' 0 C--N 1.346 0.426 0 C-N-CA 123.203 0.601 . . . . 0.0 110.598 179.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 7.1 p -68.99 149.7 11.04 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 -179.654 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -161.39 -47.74 0.04 OUTLIER 'General case' 0 C--N 1.341 0.224 0 N-CA-C 110.125 -0.324 . . . . 0.0 110.125 -179.5 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 93.3 mtt-85 -64.21 -45.37 88.6 Favored 'General case' 0 C--N 1.34 0.186 0 N-CA-C 110.148 -0.316 . . . . 0.0 110.148 -179.445 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 10.0 m -67.49 167.99 11.75 Favored 'General case' 0 C--O 1.234 0.237 0 N-CA-C 109.98 -0.378 . . . . 0.0 109.98 179.815 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 87.8 mt -75.32 72.85 2.39 Favored 'General case' 0 CA--C 1.529 0.169 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 179.578 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 29.0 mmtp 56.34 -111.69 0.64 Allowed 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 -179.399 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 9.9 p . . . . . 0 C--O 1.25 1.085 0 CA-C-O 116.769 -1.586 . . . . 0.0 110.467 -179.802 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 64.8 mtt . . . . . 0 N--CA 1.472 0.644 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 55.84 32.1 18.96 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 122.688 0.395 . . . . 0.0 110.809 -179.824 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 2.0 m -148.6 -56.51 0.21 Allowed 'General case' 0 C--N 1.343 0.287 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 178.33 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 19.6 tt -55.71 -37.9 48.6 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.444 0 N-CA-C 109.937 -0.394 . . . . 0.0 109.937 179.052 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -60.24 -64.15 1.05 Allowed 'General case' 0 N--CA 1.441 -0.91 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.295 -177.887 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -61.27 -52.82 63.15 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 122.963 0.505 . . . . 0.0 111.368 -178.177 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 86.2 t -59.36 -42.59 87.91 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.291 0 CA-C-O 119.517 -0.278 . . . . 0.0 111.272 -176.583 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -54.93 -53.71 52.05 Favored 'General case' 0 C--N 1.341 0.23 0 CA-C-N 118.014 0.37 . . . . 0.0 110.151 -179.128 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 20.1 mmmt -60.68 -47.92 84.12 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 110.006 -0.368 . . . . 0.0 110.006 -178.509 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.49 -37.16 77.52 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 116.455 -0.338 . . . . 0.0 110.624 -178.903 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -73.58 -47.84 37.45 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 122.089 0.156 . . . . 0.0 110.649 -178.489 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 50.1 t30 -171.25 139.78 1.38 Allowed 'General case' 0 C--N 1.347 0.485 0 N-CA-C 110.204 -0.295 . . . . 0.0 110.204 -177.562 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER 23.32 -87.3 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.954 0 C-N-CA 125.162 1.385 . . . . 0.0 112.811 177.636 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 71.8 m -151.18 -172.07 4.11 Favored 'General case' 0 C--N 1.348 0.518 0 C-N-CA 122.647 0.379 . . . . 0.0 110.074 -179.32 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 21.3 p -55.31 -16.19 3.19 Favored 'General case' 0 C--N 1.345 0.401 0 C-N-CA 123.253 0.621 . . . . 0.0 111.518 -179.053 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 4.7 m -52.41 -39.97 61.58 Favored 'General case' 0 CA--C 1.534 0.362 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 177.118 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 75.4 m -69.68 -40.17 76.54 Favored 'General case' 0 C--N 1.342 0.261 0 N-CA-C 109.95 -0.389 . . . . 0.0 109.95 179.054 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 84.0 t -59.46 -37.85 72.03 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.21 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 179.858 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 15.7 m -56.06 -39.12 71.55 Favored 'General case' 0 C--N 1.341 0.196 0 N-CA-C 110.067 -0.346 . . . . 0.0 110.067 179.146 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 23.8 m170 -62.57 -29.71 70.79 Favored 'General case' 0 C--O 1.223 -0.307 0 N-CA-C 110.155 -0.313 . . . . 0.0 110.155 179.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 5.1 t -80.42 -49.37 18.82 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.141 0 C-N-CA 122.202 0.201 . . . . 0.0 110.912 -177.97 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 78.9 mt -44.81 -53.99 1.35 Allowed 'Isoleucine or valine' 0 C--N 1.341 0.238 0 C-N-CA 122.811 0.444 . . . . 0.0 111.455 -175.675 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.7 p-10 -114.43 26.74 10.0 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-O 119.861 -0.114 . . . . 0.0 110.923 -177.852 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 74.1 tttt 40.61 51.68 3.01 Favored 'General case' 0 C--N 1.346 0.437 0 C-N-CA 123.009 0.524 . . . . 0.0 110.68 179.62 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -67.12 -31.81 72.52 Favored 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 -179.811 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 59.2 ttt85 -158.1 111.86 2.49 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 179.658 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 48.8 p90 -78.53 136.71 37.63 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 109.205 -0.665 . . . . 0.0 109.205 179.425 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 57.3 t -112.44 83.74 0.69 Allowed 'Isoleucine or valine' 0 N--CA 1.457 -0.121 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 179.703 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 59.44 13.4 3.21 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 115.683 -0.689 . . . . 0.0 111.535 -179.335 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 71.17 -55.93 0.64 Allowed 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 123.912 0.885 . . . . 0.0 111.538 179.431 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -45.14 -46.92 12.22 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.355 0.662 . . . . 0.0 111.853 -177.805 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 32.1 m -58.86 -39.88 82.66 Favored 'General case' 0 N--CA 1.455 -0.207 0 O-C-N 122.226 -0.296 . . . . 0.0 110.266 -178.512 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 20.2 mmt180 -70.42 -40.47 73.8 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 -178.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 13.4 m-80 -61.9 -39.73 93.02 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 178.208 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -61.21 -52.17 65.9 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 109.959 -0.386 . . . . 0.0 109.959 179.468 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 53.4 t -55.17 -50.69 62.01 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 N-CA-C 110.116 -0.327 . . . . 0.0 110.116 178.844 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 10.5 m95 -58.59 -40.71 83.99 Favored 'General case' 0 C--N 1.341 0.224 0 N-CA-C 110.368 -0.234 . . . . 0.0 110.368 -179.73 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -62.61 -49.77 73.89 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 179.473 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -56.07 -41.87 75.79 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 122.42 0.288 . . . . 0.0 110.421 179.936 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.403 ' HA ' ' CE1' ' A' ' 45' ' ' TYR . 37.3 mt -61.71 -34.47 62.37 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 N-CA-C 110.461 -0.2 . . . . 0.0 110.461 -179.805 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 4.1 ttpm? -83.0 -36.58 24.91 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 122.362 0.265 . . . . 0.0 110.708 -177.3 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -77.54 -47.79 18.63 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 122.191 0.196 . . . . 0.0 111.502 -177.076 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 79.0 mt -76.98 -29.6 55.6 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-O 119.74 -0.172 . . . . 0.0 110.842 -177.897 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 6.3 m-70 73.78 121.98 0.04 OUTLIER 'General case' 0 C--N 1.344 0.362 0 C-N-CA 123.27 0.628 . . . . 0.0 109.632 -178.612 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.403 ' CE1' ' HA ' ' A' ' 40' ' ' ILE . 3.4 m-85 -105.67 -179.85 4.06 Favored 'General case' 0 N--CA 1.463 0.185 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 -179.724 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 8.3 p -154.8 69.23 5.73 Favored Pre-proline 0 CA--C 1.537 0.455 0 N-CA-C 109.034 -0.728 . . . . 0.0 109.034 176.814 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 7.6 Cg_endo -71.32 85.53 0.86 Allowed 'Trans proline' 0 N--CA 1.448 -1.151 0 C-N-CA 122.748 2.298 . . . . 0.0 110.271 -178.417 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 15.2 t 54.75 31.05 14.68 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 122.821 0.448 . . . . 0.0 110.435 -179.875 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -167.15 167.94 13.94 Favored 'General case' 0 N--CA 1.453 -0.28 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 -179.526 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 11.0 p -153.71 145.65 14.42 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.262 0 N-CA-C 109.141 -0.688 . . . . 0.0 109.141 179.612 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -70.17 -61.23 1.86 Allowed 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 109.708 -0.479 . . . . 0.0 109.708 -179.764 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 72.9 ttt-85 -160.04 78.74 0.68 Allowed 'General case' 0 N--CA 1.455 -0.209 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 179.802 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 70.2 m 55.86 -96.84 0.07 Allowed 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 122.727 0.411 . . . . 0.0 110.324 179.771 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -162.32 167.79 23.28 Favored 'General case' 0 N--CA 1.456 -0.174 0 N-CA-C 109.438 -0.579 . . . . 0.0 109.438 179.953 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 20.6 ttpp 75.42 -60.55 0.5 Allowed 'General case' 0 C--N 1.344 0.369 0 C-N-CA 123.672 0.789 . . . . 0.0 110.566 179.898 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 8.1 p . . . . . 0 C--O 1.253 1.246 0 CA-C-O 117.193 -1.384 . . . . 0.0 109.469 -179.611 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.5 ppp? . . . . . 0 N--CA 1.473 0.719 0 N-CA-C 110.12 -0.326 . . . . 0.0 110.12 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 62.21 178.09 0.13 Allowed 'General case' 0 C--N 1.347 0.479 0 C-N-CA 123.166 0.586 . . . . 0.0 110.524 -179.418 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' THR . . . . . 0.434 ' N ' ' CE2' ' A' ' 45' ' ' TYR . 0.4 OUTLIER 78.58 -29.04 0.15 Allowed 'General case' 0 C--N 1.35 0.597 0 C-N-CA 123.425 0.69 . . . . 0.0 110.713 178.11 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 7.1 mt -125.41 -38.85 1.01 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.54 0 C-N-CA 122.656 0.383 . . . . 0.0 110.819 -178.492 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 20.8 ttpp -49.67 -55.75 12.65 Favored 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 111.879 0.325 . . . . 0.0 111.879 -176.754 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 -79.86 -42.28 24.58 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 118.247 0.476 . . . . 0.0 110.553 -176.652 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 28.6 t -57.33 -35.03 47.62 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.36 0 C-N-CA 122.442 0.297 . . . . 0.0 110.586 -180.0 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -52.93 -66.09 0.44 Allowed 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 123.224 0.609 . . . . 0.0 111.042 -178.59 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.95 -35.79 72.33 Favored 'General case' 0 C--N 1.334 -0.107 0 CA-C-O 119.592 -0.242 . . . . 0.0 110.435 -178.971 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 12.5 tpt180 -55.26 -40.35 70.86 Favored 'General case' 0 C--N 1.341 0.206 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 178.743 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -68.78 -62.75 1.25 Allowed 'General case' 0 N--CA 1.448 -0.558 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 177.615 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -177.58 -88.24 0.0 OUTLIER 'General case' 0 C--N 1.351 0.667 0 N-CA-C 112.066 0.395 . . . . 0.0 112.066 178.585 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 55.7 t -69.23 -86.38 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.343 0.291 0 C-N-CA 122.476 0.31 . . . . 0.0 111.205 -174.473 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 9.0 t -158.48 -157.94 0.67 Allowed 'General case' 0 N--CA 1.45 -0.437 0 N-CA-C 110.173 -0.306 . . . . 0.0 110.173 -177.421 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 38.0 p -55.82 -30.17 60.95 Favored 'General case' 0 C--N 1.341 0.221 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.188 -179.532 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 16.6 p -49.94 -44.51 50.5 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 122.756 0.422 . . . . 0.0 110.219 179.127 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 21.3 m -53.24 -36.26 60.88 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 122.43 0.292 . . . . 0.0 110.477 -179.686 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 25.8 t -80.86 -44.26 21.18 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.294 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 179.627 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 14.8 m -55.21 -32.23 62.08 Favored 'General case' 0 C--N 1.344 0.357 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 -179.427 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 62.4 m170 -54.83 -64.72 0.74 Allowed 'General case' 0 N--CA 1.445 -0.696 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.157 179.356 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 15.7 t -62.36 -27.82 43.43 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.246 0 C-N-CA 120.997 -0.281 . . . . 0.0 111.396 -176.495 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 6.1 mm -65.69 -51.68 59.47 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.518 0 CA-C-N 117.872 0.306 . . . . 0.0 110.826 -178.818 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -167.6 31.53 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 117.937 0.335 . . . . 0.0 111.556 -177.595 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 26.6 tptt -158.74 40.11 0.23 Allowed 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 120.69 -0.404 . . . . 0.0 110.624 -179.59 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 10.0 t -79.68 -31.02 41.3 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.664 -176.228 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 56.8 mtm180 57.36 -158.94 0.26 Allowed 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 109.549 -0.537 . . . . 0.0 109.549 179.962 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -80.4 99.17 7.83 Favored 'General case' 0 N--CA 1.453 -0.278 0 O-C-N 122.151 -0.343 . . . . 0.0 110.717 -178.006 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.0 m -143.69 161.55 16.26 Favored 'Isoleucine or valine' 0 C--O 1.233 0.221 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 175.955 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -74.0 170.17 15.98 Favored 'General case' 0 N--CA 1.446 -0.625 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 179.559 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 47.6 mm-40 -64.65 -18.01 64.56 Favored 'General case' 0 C--O 1.223 -0.306 0 N-CA-C 110.178 -0.304 . . . . 0.0 110.178 178.64 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -48.74 -55.14 12.3 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 122.943 0.497 . . . . 0.0 110.92 179.922 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 4.6 p -65.36 -41.22 94.07 Favored 'General case' 0 CA--C 1.531 0.243 0 O-C-N 122.378 -0.201 . . . . 0.0 111.045 -178.153 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 74.6 mtt85 -63.76 -53.66 47.56 Favored 'General case' 0 C--O 1.232 0.175 0 N-CA-C 111.375 0.139 . . . . 0.0 111.375 -177.205 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -69.36 -36.33 76.75 Favored 'General case' 0 C--O 1.223 -0.305 0 CA-C-O 119.677 -0.201 . . . . 0.0 110.732 -176.602 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -58.48 -50.69 72.83 Favored 'General case' 0 C--N 1.342 0.244 0 CA-C-N 117.843 0.292 . . . . 0.0 110.68 -178.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 48.7 t -58.06 -58.36 6.71 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.277 0 N-CA-C 110.559 -0.163 . . . . 0.0 110.559 -178.639 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 15.0 m95 -59.3 -40.26 85.65 Favored 'General case' 0 C--N 1.341 0.213 0 N-CA-C 110.747 -0.094 . . . . 0.0 110.747 -178.244 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -59.88 -50.8 72.35 Favored 'General case' 0 C--O 1.22 -0.455 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 -179.458 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -60.25 -47.74 84.71 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 122.026 0.131 . . . . 0.0 110.694 -179.199 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 58.5 mt -55.76 -47.41 79.41 Favored 'Isoleucine or valine' 0 C--N 1.341 0.2 0 C-N-CA 122.324 0.25 . . . . 0.0 111.105 -178.386 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -77.33 -41.14 41.67 Favored 'General case' 0 N--CA 1.448 -0.545 0 N-CA-C 110.372 -0.233 . . . . 0.0 110.372 -176.235 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -57.09 -48.46 78.56 Favored 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 110.161 -0.311 . . . . 0.0 110.161 -178.489 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 55.4 mt -83.7 -20.7 33.01 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.022 -178.458 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 91.4 m-70 55.89 26.53 9.85 Favored 'General case' 0 C--N 1.351 0.632 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 -176.956 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.434 ' CE2' ' N ' ' A' ' 3' ' ' THR . 16.6 t80 52.1 82.78 0.06 Allowed 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 123.319 0.648 . . . . 0.0 109.772 -175.541 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 22.8 t -109.98 104.1 54.86 Favored Pre-proline 0 CA--C 1.537 0.442 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 -179.866 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -69.79 176.19 7.12 Favored 'Trans proline' 0 N--CA 1.45 -1.048 0 C-N-CA 122.533 2.155 . . . . 0.0 110.536 179.902 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 15.0 m -54.51 -34.92 62.56 Favored 'General case' 0 C--N 1.342 0.257 0 CA-C-N 116.383 -0.372 . . . . 0.0 110.675 179.76 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -79.52 62.56 3.86 Favored 'General case' 0 C--N 1.342 0.272 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 179.772 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 59.4 t -60.31 -35.45 62.41 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 N-CA-C 109.88 -0.415 . . . . 0.0 109.88 -179.907 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -63.18 -25.4 68.33 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 122.44 0.296 . . . . 0.0 110.88 -179.721 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 72.3 mtp85 54.22 53.78 10.5 Favored 'General case' 0 C--N 1.346 0.454 0 N-CA-C 109.765 -0.458 . . . . 0.0 109.765 -179.074 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 27.6 m -148.41 36.86 0.82 Allowed 'General case' 0 CA--C 1.529 0.147 0 N-CA-C 109.914 -0.402 . . . . 0.0 109.914 179.678 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 3.0 mp -128.27 140.3 51.96 Favored 'General case' 0 C--N 1.341 0.235 0 N-CA-C 108.936 -0.764 . . . . 0.0 108.936 179.655 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 66.2 mttp -81.41 137.72 35.65 Favored 'General case' 0 N--CA 1.455 -0.199 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 179.939 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 58.3 t . . . . . 0 C--O 1.248 1.021 0 CA-C-O 116.945 -1.502 . . . . 0.0 108.863 179.932 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 57.9 ttm . . . . . 0 N--CA 1.475 0.78 0 N-CA-C 109.967 -0.382 . . . . 0.0 109.967 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -162.77 -88.26 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 179.808 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 2.4 m 77.78 178.95 0.14 Allowed 'General case' 0 C--N 1.344 0.358 0 N-CA-C 108.384 -0.969 . . . . 0.0 108.384 178.698 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -41.48 -36.57 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.347 0.468 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 179.004 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 26.2 mmtp -46.53 -62.07 1.53 Allowed 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 122.837 0.455 . . . . 0.0 111.187 179.043 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 30.1 m-20 -91.17 -32.46 15.8 Favored 'General case' 0 C--N 1.347 0.468 0 CA-C-N 117.909 0.322 . . . . 0.0 111.425 -176.337 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 70.4 t -58.12 -42.97 84.46 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 179.222 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.94 -42.64 97.27 Favored 'General case' 0 C--O 1.22 -0.451 0 N-CA-C 110.372 -0.233 . . . . 0.0 110.372 179.823 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 41.3 mtpt -61.34 -47.51 85.57 Favored 'General case' 0 C--N 1.338 0.108 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 179.627 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -55.19 -39.89 70.09 Favored 'General case' 0 N--CA 1.454 -0.233 0 N-CA-C 109.492 -0.559 . . . . 0.0 109.492 179.602 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -70.31 -56.55 6.45 Favored 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 110.368 -0.234 . . . . 0.0 110.368 179.847 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 45.2 t30 -170.91 126.34 0.7 Allowed 'General case' 0 C--N 1.347 0.487 0 CA-C-N 117.387 0.085 . . . . 0.0 111.194 -177.743 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 51.3 t 51.68 -91.31 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.539 0 C-N-CA 123.895 0.878 . . . . 0.0 111.809 176.419 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 28.3 m -157.44 -169.93 3.06 Favored 'General case' 0 C--N 1.346 0.417 0 N-CA-C 109.785 -0.45 . . . . 0.0 109.785 -177.591 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 80.4 p -49.87 -26.7 4.3 Favored 'General case' 0 C--N 1.347 0.496 0 C-N-CA 123.212 0.605 . . . . 0.0 111.104 -179.771 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 18.6 p -50.25 -44.19 53.42 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 122.396 0.279 . . . . 0.0 110.289 179.063 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.3 t -59.88 -37.63 79.89 Favored 'General case' 0 CA--C 1.534 0.333 0 N-CA-C 110.563 -0.162 . . . . 0.0 110.563 -178.621 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 64.6 t -68.62 -45.6 81.29 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.246 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 179.821 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 20.2 m -57.16 -45.74 83.35 Favored 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 179.076 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 52.2 m170 -57.66 -46.32 84.38 Favored 'General case' 0 C--N 1.339 0.152 0 C-N-CA 122.353 0.261 . . . . 0.0 110.373 -179.743 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 32.9 t -65.41 -51.93 58.04 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.05 -178.101 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 94.9 mt -59.49 -54.1 39.14 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.217 0 N-CA-C 110.377 -0.231 . . . . 0.0 110.377 -177.912 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 43.5 m-80 -70.61 -18.98 62.88 Favored 'General case' 0 CA--C 1.532 0.288 0 N-CA-C 110.386 -0.227 . . . . 0.0 110.386 -179.007 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 74.2 tttt 61.05 46.14 8.56 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 122.878 0.471 . . . . 0.0 109.928 179.476 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 15.8 p -96.25 -80.18 0.43 Allowed 'General case' 0 C--N 1.341 0.199 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 179.632 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 78.7 ttt180 -78.81 100.76 7.29 Favored 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 108.968 -0.752 . . . . 0.0 108.968 179.15 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 90.8 t80 -62.11 144.13 55.73 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 109.967 -0.383 . . . . 0.0 109.967 -179.995 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 5.4 m -130.67 170.8 18.83 Favored 'Isoleucine or valine' 0 CA--C 1.523 -0.081 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 179.463 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -61.78 158.4 15.85 Favored 'General case' 0 N--CA 1.45 -0.449 0 N-CA-C 109.978 -0.379 . . . . 0.0 109.978 179.796 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 50.7 mm-40 -48.73 -45.01 38.9 Favored 'General case' 0 C--N 1.34 0.178 0 CA-C-N 116.042 -0.526 . . . . 0.0 109.889 179.049 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -52.85 -53.7 45.07 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 122.715 0.406 . . . . 0.0 111.436 -178.146 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 10.0 m -61.15 -51.94 66.96 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 117.804 0.274 . . . . 0.0 110.817 -177.179 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 30.9 ttp180 -58.53 -52.76 64.27 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 122.02 0.128 . . . . 0.0 110.798 -177.931 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 90.5 m-20 -63.34 -40.67 97.94 Favored 'General case' 0 N--CA 1.455 -0.189 0 N-CA-C 110.465 -0.198 . . . . 0.0 110.465 -178.025 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -61.14 -47.85 84.31 Favored 'General case' 0 C--O 1.224 -0.258 0 N-CA-C 110.284 -0.265 . . . . 0.0 110.284 -179.885 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 13.1 t -54.31 -52.41 39.08 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 179.926 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 26.0 m95 -62.85 -38.21 89.9 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 110.059 -0.348 . . . . 0.0 110.059 179.874 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -89.01 28.12 1.24 Allowed 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 122.251 0.22 . . . . 0.0 110.606 179.784 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -131.14 -46.63 1.01 Allowed 'General case' 0 N--CA 1.456 -0.14 0 N-CA-C 108.474 -0.936 . . . . 0.0 108.474 176.76 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 60.7 mt -55.48 -46.77 78.9 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.224 0 N-CA-C 109.839 -0.43 . . . . 0.0 109.839 178.902 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 4.6 ptpp? -107.81 32.93 4.36 Favored 'General case' 0 C--N 1.344 0.365 0 C-N-CA 122.144 0.178 . . . . 0.0 110.634 -178.609 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -138.77 -55.75 0.61 Allowed 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 179.181 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -85.18 13.67 6.06 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 110.048 -0.352 . . . . 0.0 110.048 179.309 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 3.8 t-80 78.39 149.95 0.11 Allowed 'General case' 0 N--CA 1.446 -0.632 0 CA-C-O 121.807 0.813 . . . . 0.0 110.88 177.644 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 26.2 t80 -156.95 147.64 21.56 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 114.336 -1.302 . . . . 0.0 108.812 179.003 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 64.9 m -130.38 93.16 33.43 Favored Pre-proline 0 CA--C 1.533 0.31 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 -179.494 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 1.4 Cg_endo -65.86 170.85 10.76 Favored 'Trans proline' 0 N--CA 1.45 -1.086 0 C-N-CA 122.445 2.097 . . . . 0.0 110.656 179.526 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 12.9 p -75.14 151.15 38.57 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 109.759 -0.46 . . . . 0.0 109.759 179.562 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . 51.81 69.65 0.64 Allowed 'General case' 0 C--N 1.344 0.331 0 C-N-CA 122.863 0.465 . . . . 0.0 110.504 179.616 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 3.3 m -70.65 79.75 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 179.6 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 57.73 29.94 18.16 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 122.993 0.517 . . . . 0.0 110.24 -179.563 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 44.7 mtm105 -147.01 114.65 6.4 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 -179.894 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 17.3 p -60.77 -54.48 44.74 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 109.449 -0.574 . . . . 0.0 109.449 179.488 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 6.2 tp 50.54 -125.57 2.25 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 109.719 -0.475 . . . . 0.0 109.719 179.115 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 83.2 tttt -159.56 124.53 4.05 Favored 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 179.548 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 32.6 m . . . . . 0 C--O 1.251 1.181 0 CA-C-O 116.086 -1.912 . . . . 0.0 110.817 -178.769 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.487 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 0.3 OUTLIER . . . . . 0 CA--C 1.54 0.567 0 N-CA-C 109.94 -0.392 . . . . 0.0 109.94 . . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 34.5 ttmt -55.55 -39.65 70.89 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 122.846 0.458 . . . . 0.0 111.081 -178.944 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -51.51 -64.93 0.65 Allowed 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 122.898 0.479 . . . . 0.0 111.414 -176.731 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 86.8 t -69.39 -31.81 50.87 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.371 0 N-CA-C 110.646 -0.131 . . . . 0.0 110.646 -177.211 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.04 -41.97 97.58 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 110.267 -0.272 . . . . 0.0 110.267 -179.888 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 31.4 mmtm -81.3 -31.58 33.53 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 122.439 0.296 . . . . 0.0 110.822 -179.168 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 1.3 tpm_? -75.64 -47.52 26.07 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 117.427 0.103 . . . . 0.0 111.047 -177.898 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -80.68 -49.03 11.74 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 122.163 0.185 . . . . 0.0 111.006 -177.073 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 22.4 m-80 -123.66 -145.41 0.34 Allowed 'General case' 0 C--N 1.341 0.23 0 N-CA-C 109.735 -0.469 . . . . 0.0 109.735 -177.967 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 58.6 t -102.22 -41.95 8.42 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.249 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 -179.902 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 8.3 t -155.16 176.85 12.02 Favored 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 109.925 -0.398 . . . . 0.0 109.925 -179.752 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 12.6 m -61.47 -21.47 64.2 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.617 -179.284 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 3.7 m -52.18 -49.16 64.38 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 110.179 -0.304 . . . . 0.0 110.179 179.379 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 7.1 m -65.43 -33.32 75.66 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 122.148 0.179 . . . . 0.0 110.722 -179.369 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 58.5 t -68.32 -45.58 82.31 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 -179.79 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 60.4 p -60.42 -35.72 76.47 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-O 119.731 -0.176 . . . . 0.0 110.739 -178.787 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 55.0 m170 -52.61 -37.54 58.45 Favored 'General case' 0 C--N 1.347 0.466 0 CA-C-O 120.568 0.223 . . . . 0.0 110.631 -179.882 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 60.1 t -72.35 -40.2 64.37 Favored 'Isoleucine or valine' 0 C--O 1.234 0.278 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.493 -178.88 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 76.2 mt -68.84 -56.18 13.04 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.194 0 C-N-CA 122.405 0.282 . . . . 0.0 110.514 -177.854 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 31.1 p30 -76.55 -10.92 59.74 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 119.701 -0.19 . . . . 0.0 111.216 -177.877 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 39.7 mtmt 56.45 38.7 29.91 Favored 'General case' 0 C--N 1.345 0.411 0 C-N-CA 122.674 0.389 . . . . 0.0 110.319 179.257 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 10.3 t -82.23 -34.18 28.97 Favored 'General case' 0 C--N 1.34 0.155 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 179.91 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 89.2 mtt-85 -134.18 69.97 1.46 Allowed 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 178.236 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 87.5 t80 -59.47 111.16 1.29 Allowed 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 116.097 -0.501 . . . . 0.0 109.78 -179.038 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.577 HG12 ' H ' ' A' ' 29' ' ' ALA . 12.0 t -76.13 173.68 0.93 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 179.31 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.577 ' H ' HG12 ' A' ' 28' ' ' VAL . . . -76.89 52.61 0.87 Allowed 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 122.337 0.255 . . . . 0.0 111.455 -178.056 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 69.08 -32.16 0.22 Allowed 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.025 0.93 . . . . 0.0 112.975 177.023 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 51.6 mt-10 -50.87 -61.93 1.91 Allowed 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 118.52 0.6 . . . . 0.0 110.836 -177.916 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 45.5 m -61.14 -41.19 96.29 Favored 'General case' 0 C--O 1.225 -0.204 0 CA-C-N 116.738 -0.21 . . . . 0.0 110.599 -178.482 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 12.1 ttm180 -56.04 -55.39 33.4 Favored 'General case' 0 CA--C 1.531 0.247 0 N-CA-C 110.286 -0.265 . . . . 0.0 110.286 -179.152 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 21.5 m120 -61.84 -46.05 91.14 Favored 'General case' 0 N--CA 1.455 -0.201 0 N-CA-C 110.282 -0.266 . . . . 0.0 110.282 -179.353 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -56.84 -43.07 80.74 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 122.194 0.198 . . . . 0.0 110.785 -179.12 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 16.4 t -63.43 -57.47 11.72 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.184 0 N-CA-C 110.339 -0.245 . . . . 0.0 110.339 -178.875 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 19.0 m95 -58.87 -37.79 77.35 Favored 'General case' 0 CA--C 1.53 0.197 0 N-CA-C 110.682 -0.118 . . . . 0.0 110.682 -178.466 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -66.02 -53.13 42.52 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 109.953 -0.388 . . . . 0.0 109.953 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.96 -41.62 87.93 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 122.54 0.336 . . . . 0.0 110.893 -178.611 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 19.7 mt -53.37 -46.14 57.67 Favored 'Isoleucine or valine' 0 C--N 1.34 0.194 0 C-N-CA 122.218 0.207 . . . . 0.0 110.547 -179.38 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 7.8 mtpm? -79.82 -37.35 35.28 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 110.303 -0.258 . . . . 0.0 110.303 -177.848 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -59.34 -57.28 13.68 Favored 'General case' 0 N--CA 1.451 -0.379 0 N-CA-C 110.109 -0.33 . . . . 0.0 110.109 -178.523 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -70.91 -43.21 68.76 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 -179.68 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 9.9 t60 65.03 118.72 0.02 OUTLIER 'General case' 0 C--N 1.349 0.567 0 C-N-CA 123.462 0.705 . . . . 0.0 110.091 -178.834 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.487 ' CE2' ' HA ' ' A' ' 4' ' ' ILE . 0.0 OUTLIER . . . . . 0 CA--C 1.53 0.194 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.276 -179.4 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 15.3 tt . . . . . 0 N--CA 1.467 0.404 0 CA-C-O 120.389 0.137 . . . . 0.0 111.214 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 3.6 mmmm -70.19 -58.96 3.19 Favored 'General case' 0 N--CA 1.447 -0.576 0 N-CA-C 110.175 -0.305 . . . . 0.0 110.175 -179.735 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -59.83 -56.75 17.89 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 123.403 0.44 . . . . 0.0 111.749 -176.948 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.508 HG23 ' H ' ' A' ' 8' ' ' ALA . 17.1 m -43.55 -56.07 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 C-N-CA 122.83 0.452 . . . . 0.0 112.196 -174.039 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.508 ' H ' HG23 ' A' ' 7' ' ' VAL . . . -48.17 -50.24 29.7 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.769 -178.329 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 8.5 mptt -74.66 -34.32 62.69 Favored 'General case' 0 CA--C 1.534 0.347 0 O-C-N 122.436 -0.165 . . . . 0.0 110.736 -178.496 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 11.0 mmt-85 -58.78 -56.19 25.4 Favored 'General case' 0 C--N 1.341 0.205 0 N-CA-C 109.502 -0.555 . . . . 0.0 109.502 179.093 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -68.96 -8.23 42.64 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.688 179.498 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 60.9 63.11 1.33 Allowed 'General case' 0 C--N 1.343 0.291 0 C-N-CA 123.018 0.527 . . . . 0.0 110.254 178.963 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 2.1 m -137.2 -109.48 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.455 -0.191 0 N-CA-C 108.518 -0.919 . . . . 0.0 108.518 177.677 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 10.0 p -169.25 147.05 3.67 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 179.812 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 9.3 t -51.39 -33.06 28.38 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.534 179.552 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 20.2 p -49.83 -54.21 20.76 Favored 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 109.863 -0.421 . . . . 0.0 109.863 179.075 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 10.5 m -53.31 -46.05 69.23 Favored 'General case' 0 N--CA 1.456 -0.151 0 C-N-CA 122.63 0.372 . . . . 0.0 110.094 179.466 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 20.1 t -64.85 -27.08 41.62 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.18 0 CA-C-N 116.433 -0.348 . . . . 0.0 110.824 -178.577 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 45.2 m -77.42 -48.86 16.12 Favored 'General case' 0 CA--C 1.506 -0.732 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 179.844 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 18.2 m-70 -55.54 -39.82 71.08 Favored 'General case' 0 C--O 1.201 -1.47 0 O-C-N 123.329 0.393 . . . . 0.0 110.046 -179.626 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 19.6 t -52.16 -32.89 16.12 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.389 0 CA-C-N 118.192 0.451 . . . . 0.0 110.784 -179.367 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 32.1 mm -75.33 -34.96 31.89 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.415 0 N-CA-C 111.989 0.366 . . . . 0.0 111.989 -177.738 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.3 p-10 -100.56 -40.32 7.47 Favored 'General case' 0 N--CA 1.481 1.097 0 CA-C-N 118.398 0.545 . . . . 0.0 111.337 -176.486 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.821 ' O ' HG23 ' A' ' 25' ' ' THR . 36.2 ttpt -153.74 -89.89 0.05 OUTLIER 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 108.13 -1.063 . . . . 0.0 108.13 179.142 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' THR . . . . . 0.821 HG23 ' O ' ' A' ' 24' ' ' LYS . 0.8 OUTLIER 173.53 -41.75 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.294 0.637 . . . . 0.0 110.283 177.605 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 38.3 ttt85 57.91 46.12 17.22 Favored 'General case' 0 CA--C 1.535 0.385 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 -178.099 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 22.5 t80 74.19 126.18 0.04 OUTLIER 'General case' 0 C--N 1.346 0.456 0 C-N-CA 123.615 0.766 . . . . 0.0 110.684 -179.804 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 5.8 m -141.96 168.06 15.17 Favored 'Isoleucine or valine' 0 C--N 1.342 0.254 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 178.766 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -100.59 25.78 7.43 Favored 'General case' 0 CA--C 1.531 0.218 0 N-CA-C 109.897 -0.409 . . . . 0.0 109.897 179.38 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 68.5 -65.81 0.26 Allowed 'General case' 0 C--N 1.352 0.684 0 C-N-CA 123.909 0.883 . . . . 0.0 110.704 -179.398 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 68.1 mt-10 -53.54 -33.71 55.59 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 122.775 0.43 . . . . 0.0 110.803 -179.824 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 9.9 p -66.8 -54.81 18.76 Favored 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 -179.374 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 2.4 tmt_? -55.53 -45.64 77.14 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 110.079 -0.341 . . . . 0.0 110.079 179.821 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 86.6 m-20 -64.43 -48.74 74.2 Favored 'General case' 0 CA--C 1.53 0.199 0 N-CA-C 110.493 -0.188 . . . . 0.0 110.493 -179.073 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -58.04 -43.63 86.91 Favored 'General case' 0 C--N 1.34 0.157 0 N-CA-C 110.336 -0.246 . . . . 0.0 110.336 -179.455 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 21.7 t -56.81 -54.21 32.44 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.214 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 179.913 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 18.0 m95 -60.66 -39.88 90.01 Favored 'General case' 0 N--CA 1.456 -0.154 0 N-CA-C 110.568 -0.16 . . . . 0.0 110.568 -179.532 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -58.83 -52.37 66.01 Favored 'General case' 0 N--CA 1.455 -0.193 0 N-CA-C 109.946 -0.39 . . . . 0.0 109.946 -179.067 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -62.62 -44.52 96.08 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 122.294 0.238 . . . . 0.0 110.508 -179.774 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 29.4 mt -58.12 -39.11 71.45 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.196 0 N-CA-C 110.247 -0.279 . . . . 0.0 110.247 -179.658 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 65.2 mmtt -78.1 -34.11 50.27 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 109.925 -0.398 . . . . 0.0 109.925 -178.901 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -63.85 -58.48 6.66 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 110.407 -0.22 . . . . 0.0 110.407 -178.946 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 79.2 mt -85.62 -2.13 57.85 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 122.223 0.209 . . . . 0.0 110.913 -178.547 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 4.4 m-70 63.71 13.37 7.34 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 123.137 0.575 . . . . 0.0 110.767 -179.42 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 7.6 t80 . . . . . 0 C--N 1.347 0.472 0 C-N-CA 124.035 0.934 . . . . 0.0 111.153 -178.7 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.418 HD13 ' O ' ' A' ' 4' ' ' ILE . 0.1 OUTLIER . . . . . 0 CA--C 1.536 0.437 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 . . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 27.1 mmtp -59.52 -58.79 7.04 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 120.733 0.301 . . . . 0.0 110.381 -178.552 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -57.36 -50.64 72.32 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.624 -179.121 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.485 HG22 HD12 ' A' ' 43' ' ' LEU . 29.3 t -53.66 -54.51 18.74 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.092 0 C-N-CA 123.045 0.538 . . . . 0.0 110.491 -179.715 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -55.09 -58.61 6.95 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.728 -177.332 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 32.6 mtmm -59.63 -34.57 72.95 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 110.422 -0.214 . . . . 0.0 110.422 -177.775 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 49.2 tpt85 -64.91 -35.12 80.13 Favored 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 177.061 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -84.56 8.21 17.42 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 122.691 0.396 . . . . 0.0 110.256 178.236 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 61.4 t30 69.98 42.42 1.02 Allowed 'General case' 0 C--N 1.346 0.447 0 C-N-CA 123.974 0.909 . . . . 0.0 111.454 177.424 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 3.6 m -145.16 143.35 22.27 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.518 0 N-CA-C 108.21 -1.033 . . . . 0.0 108.21 176.03 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 74.3 m -71.7 -65.65 0.73 Allowed 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.865 -0.42 . . . . 0.0 109.865 -178.257 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 5.2 t 179.71 -33.02 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 123.964 0.905 . . . . 0.0 108.869 -179.753 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 11.7 p -57.84 -49.08 77.89 Favored 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 178.272 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 12.0 m -56.76 -36.09 69.4 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 110.228 -0.286 . . . . 0.0 110.228 179.215 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 71.6 t -69.99 -38.47 75.42 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.178 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 178.218 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 17.4 m -61.66 -33.36 73.84 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 109.755 -0.461 . . . . 0.0 109.755 179.152 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 50.8 m170 -61.29 -30.48 70.51 Favored 'General case' 0 C--N 1.346 0.431 0 N-CA-C 110.385 -0.228 . . . . 0.0 110.385 179.496 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 93.1 t -63.96 -52.04 61.67 Favored 'Isoleucine or valine' 0 C--N 1.341 0.215 0 N-CA-C 109.522 -0.547 . . . . 0.0 109.522 179.911 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 4.8 mm -64.41 -49.96 78.42 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.164 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 179.656 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 33.8 t-20 -59.86 -31.75 70.06 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 116.528 -0.305 . . . . 0.0 110.205 -179.262 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 31.9 ttpt 64.34 46.02 3.61 Favored 'General case' 0 CA--C 1.532 0.282 0 N-CA-C 109.503 -0.555 . . . . 0.0 109.503 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 15.2 p -115.55 -87.06 0.6 Allowed 'General case' 0 C--N 1.341 0.233 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 -179.847 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 47.5 mmm-85 -94.73 54.6 1.78 Allowed 'General case' 0 C--O 1.233 0.22 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 -179.34 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 27.6 p90 -72.57 144.24 47.98 Favored 'General case' 0 N--CA 1.453 -0.287 0 N-CA-C 109.379 -0.601 . . . . 0.0 109.379 179.7 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 19.7 t -87.54 80.1 1.77 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.286 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 -179.548 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 54.55 -143.33 0.74 Allowed 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.203 179.397 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 69.1 mt-10 -115.05 -25.27 8.2 Favored 'General case' 0 CA--C 1.528 0.125 0 C-N-CA 122.892 0.477 . . . . 0.0 110.284 179.705 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 70.0 mm-40 -55.24 -61.8 2.09 Favored 'General case' 0 C--O 1.232 0.163 0 N-CA-C 110.148 -0.315 . . . . 0.0 110.148 -179.783 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 9.6 m -62.65 -40.1 95.96 Favored 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 179.925 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 13.9 ttm180 -52.03 -48.96 64.3 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 122.701 0.4 . . . . 0.0 110.308 -179.657 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 22.4 t-20 -71.09 -47.52 57.76 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.336 -179.174 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -54.63 -39.79 68.31 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 122.42 0.288 . . . . 0.0 110.945 -178.955 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 17.5 t -60.39 -60.88 1.91 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.279 0 N-CA-C 109.84 -0.43 . . . . 0.0 109.84 -179.524 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 26.0 m95 -58.34 -37.33 74.94 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-O 119.969 -0.062 . . . . 0.0 110.946 -178.196 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -61.37 -55.93 26.07 Favored 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 109.808 -0.442 . . . . 0.0 109.808 179.069 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.5 -42.49 87.78 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 122.611 0.364 . . . . 0.0 110.895 -179.033 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 27.4 mt -52.71 -56.87 5.51 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.193 0 C-N-CA 122.54 0.336 . . . . 0.0 110.703 -178.779 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -83.67 0.09 48.47 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-O 119.6 -0.238 . . . . 0.0 111.541 -176.818 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.6 tm-20 -88.7 -46.48 8.98 Favored 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 109.181 -0.674 . . . . 0.0 109.181 179.435 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.485 HD12 HG22 ' A' ' 7' ' ' VAL . 6.9 mt -72.38 -92.32 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 119.27 -0.395 . . . . 0.0 110.71 -178.514 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 54.9 m80 -158.79 18.0 0.2 Allowed 'General case' 0 C--N 1.352 0.694 0 N-CA-C 112.763 0.653 . . . . 0.0 112.763 -175.608 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 66.7 t80 . . . . . 0 N--CA 1.464 0.234 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 179.003 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.1 mt . . . . . 0 CA--C 1.541 0.625 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -82.29 -58.06 3.1 Favored 'General case' 0 N--CA 1.45 -0.454 0 C-N-CA 123.412 0.685 . . . . 0.0 110.41 -177.588 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 32.9 m-20 -82.23 -34.24 28.95 Favored 'General case' 0 C--O 1.224 -0.268 0 N-CA-C 110.377 -0.231 . . . . 0.0 110.377 -177.0 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 31.2 t -54.16 -52.56 36.48 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.259 0 N-CA-C 110.092 -0.336 . . . . 0.0 110.092 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.65 -45.73 88.84 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-O 120.499 0.19 . . . . 0.0 110.663 -178.853 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 18.3 mmtp -67.1 -24.71 65.96 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-O 119.614 -0.231 . . . . 0.0 111.224 -178.132 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 1.6 tmm_? -60.65 -43.61 97.38 Favored 'General case' 0 C--N 1.343 0.316 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 177.887 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -85.18 -0.28 54.08 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 178.466 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 67.39 48.73 1.11 Allowed 'General case' 0 C--N 1.345 0.411 0 C-N-CA 123.202 0.601 . . . . 0.0 110.268 178.651 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 27.6 m -143.22 174.1 5.28 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 178.531 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 21.3 m -88.69 161.84 16.62 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 122.672 0.389 . . . . 0.0 110.074 -179.941 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 14.1 t -56.4 -32.35 64.73 Favored 'General case' 0 N--CA 1.463 0.223 0 C-N-CA 122.509 0.324 . . . . 0.0 110.763 -179.851 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 13.8 p -58.86 -45.62 89.69 Favored 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 178.823 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -55.94 -42.35 76.03 Favored 'General case' 0 N--CA 1.453 -0.278 0 N-CA-C 109.884 -0.413 . . . . 0.0 109.884 179.612 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 78.5 t -64.87 -43.47 96.33 Favored 'Isoleucine or valine' 0 C--N 1.34 0.177 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 179.185 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 14.4 t -57.67 -37.25 73.09 Favored 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 110.151 -0.314 . . . . 0.0 110.151 179.622 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 54.7 m170 -59.13 -28.07 66.21 Favored 'General case' 0 C--N 1.344 0.332 0 N-CA-C 110.398 -0.223 . . . . 0.0 110.398 -179.941 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 36.7 t -77.79 -43.69 29.0 Favored 'Isoleucine or valine' 0 C--O 1.232 0.154 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 178.984 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 77.2 mt -57.98 -58.42 6.44 Favored 'Isoleucine or valine' 0 C--N 1.34 0.163 0 N-CA-C 109.519 -0.548 . . . . 0.0 109.519 -179.436 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 26.5 p30 -73.84 -14.42 61.08 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 110.283 -0.266 . . . . 0.0 110.283 -179.849 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 62.22 32.63 17.15 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 122.978 0.511 . . . . 0.0 111.254 177.035 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 14.8 t -70.23 -29.32 66.12 Favored 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 177.56 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 74.3 mtt85 -141.81 98.33 3.32 Favored 'General case' 0 C--N 1.343 0.309 0 N-CA-C 108.115 -1.069 . . . . 0.0 108.115 178.148 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 88.5 t80 -65.88 108.6 2.21 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 110.234 -0.284 . . . . 0.0 110.234 -178.601 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 30.3 m -72.82 172.88 0.96 Allowed 'Isoleucine or valine' 0 N--CA 1.457 -0.118 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 178.235 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -65.03 159.3 23.44 Favored 'General case' 0 N--CA 1.449 -0.477 0 N-CA-C 109.684 -0.487 . . . . 0.0 109.684 178.952 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 29.5 mm-40 -50.63 -43.01 56.86 Favored 'General case' 0 C--O 1.223 -0.336 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.155 179.473 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 9.5 tm-20 -52.17 -53.23 45.68 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 122.217 0.207 . . . . 0.0 110.632 -179.364 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 10.0 m -65.55 -52.66 50.75 Favored 'General case' 0 N--CA 1.442 -0.855 0 CA-C-O 119.593 -0.242 . . . . 0.0 111.453 -175.25 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 6.8 ppt_? -62.19 -39.51 92.97 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 118.277 0.49 . . . . 0.0 110.958 -176.784 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 49.2 m-80 -67.17 -46.61 73.47 Favored 'General case' 0 C--N 1.34 0.194 0 N-CA-C 109.549 -0.537 . . . . 0.0 109.549 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -58.64 -42.01 87.36 Favored 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 110.21 -0.293 . . . . 0.0 110.21 179.717 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 18.8 t -63.94 -58.3 7.92 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.216 0 C-N-CA 122.381 0.272 . . . . 0.0 110.314 -179.514 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 19.3 m95 -57.87 -37.76 74.51 Favored 'General case' 0 C--N 1.342 0.261 0 N-CA-C 110.444 -0.206 . . . . 0.0 110.444 -178.371 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -64.13 -52.55 58.59 Favored 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 179.266 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -55.74 -45.46 78.0 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 122.449 0.3 . . . . 0.0 111.038 -178.602 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 46.5 mt -55.26 -43.53 71.33 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 C-N-CA 122.2 0.2 . . . . 0.0 110.985 -178.116 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 36.6 mtmm -78.32 -43.54 27.61 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 109.983 -0.377 . . . . 0.0 109.983 -177.541 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 24.0 mm-40 -57.15 -47.77 80.36 Favored 'General case' 0 N--CA 1.448 -0.542 0 O-C-N 123.152 0.282 . . . . 0.0 110.761 -178.466 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -85.52 -0.68 55.69 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-O 119.669 -0.205 . . . . 0.0 110.636 -178.876 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 21.2 m80 57.14 38.47 29.01 Favored 'General case' 0 C--N 1.345 0.406 0 C-N-CA 122.651 0.38 . . . . 0.0 110.689 178.687 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 1.5 m-85 . . . . . 0 C--N 1.327 -0.397 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.258 179.791 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 21.3 tt . . . . . 0 C--O 1.226 -0.177 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -60.47 -60.25 4.11 Favored 'General case' 0 N--CA 1.447 -0.608 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 178.993 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 29.2 m-20 -54.22 -43.36 70.75 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.262 179.379 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 42.8 t -59.53 -36.67 66.12 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.28 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 178.409 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -68.11 -40.04 82.63 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 110.273 -0.269 . . . . 0.0 110.273 179.755 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 52.9 mttt -62.48 -40.44 96.69 Favored 'General case' 0 C--N 1.343 0.289 0 N-CA-C 108.485 -0.931 . . . . 0.0 108.485 177.733 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 27.1 mtt180 -60.03 -43.58 95.2 Favored 'General case' 0 C--N 1.341 0.229 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 176.415 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -73.77 9.85 1.33 Allowed 'General case' 0 CA--C 1.541 0.635 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.632 177.023 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 8.1 m-80 75.07 149.19 0.1 Allowed 'General case' 0 C--N 1.353 0.739 0 C-N-CA 124.296 1.038 . . . . 0.0 111.613 177.199 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 40.8 t 64.02 -86.6 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.455 -0.18 0 CA-C-N 114.393 -1.276 . . . . 0.0 110.559 177.116 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 9.3 t -174.88 -162.74 0.12 Allowed 'General case' 0 C--O 1.233 0.234 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 -177.045 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 20.0 p -57.91 -19.93 33.49 Favored 'General case' 0 C--O 1.222 -0.347 0 C-N-CA 123.133 0.573 . . . . 0.0 111.314 -179.282 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 4.6 m -53.5 -49.51 67.38 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 110.277 -0.268 . . . . 0.0 110.277 179.668 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 26.1 m -62.4 -44.3 96.78 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 110.296 -0.261 . . . . 0.0 110.296 -179.289 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 92.6 t -61.29 -42.25 92.84 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 -179.839 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 50.3 m -61.3 -40.72 95.21 Favored 'General case' 0 N--CA 1.454 -0.243 0 N-CA-C 110.159 -0.311 . . . . 0.0 110.159 -179.496 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 47.0 m170 -59.36 -41.3 88.93 Favored 'General case' 0 C--N 1.339 0.149 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 -179.825 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 54.0 t -70.47 -52.48 28.93 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 O-C-N 123.035 0.21 . . . . 0.0 110.791 -178.674 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 93.1 mt -63.44 -51.87 65.22 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 N-CA-C 110.393 -0.225 . . . . 0.0 110.393 -177.635 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 14.6 t-20 -68.56 -34.88 76.6 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-O 119.665 -0.207 . . . . 0.0 110.517 -178.483 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 23.1 mtmm 70.56 60.09 0.22 Allowed 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 123.373 0.669 . . . . 0.0 109.507 -179.398 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 19.3 p -87.33 -80.35 0.26 Allowed 'General case' 0 C--N 1.34 0.167 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 179.201 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 8.7 ptm180 -86.76 163.1 17.48 Favored 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 109.843 -0.429 . . . . 0.0 109.843 179.41 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 89.1 t80 -80.99 142.25 33.62 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 179.617 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 9.0 m -141.17 158.19 22.61 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.183 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 178.544 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -73.22 160.2 32.28 Favored 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 179.499 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 15.1 mm-40 -58.53 -24.38 60.47 Favored 'General case' 0 C--O 1.223 -0.298 0 N-CA-C 110.099 -0.334 . . . . 0.0 110.099 179.071 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.7 tm-20 -56.21 -53.01 62.28 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 109.705 -0.48 . . . . 0.0 109.705 178.034 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 3.9 m -64.03 -48.68 75.35 Favored 'General case' 0 N--CA 1.449 -0.517 0 C-N-CA 122.247 0.219 . . . . 0.0 110.477 -177.487 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 28.3 mtm180 -57.84 -54.25 48.99 Favored 'General case' 0 CA--C 1.528 0.119 0 N-CA-C 110.051 -0.351 . . . . 0.0 110.051 -179.16 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 48.6 t30 -57.73 -48.82 78.51 Favored 'General case' 0 C--O 1.224 -0.272 0 C-N-CA 122.785 0.434 . . . . 0.0 110.339 -178.828 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -55.85 -47.16 77.77 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 122.112 0.165 . . . . 0.0 110.651 -178.968 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 39.2 t -63.44 -56.4 17.29 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.15 0 N-CA-C 110.474 -0.195 . . . . 0.0 110.474 -178.82 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 19.5 m95 -57.21 -40.19 76.99 Favored 'General case' 0 C--O 1.233 0.202 0 N-CA-C 110.516 -0.179 . . . . 0.0 110.516 -178.56 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -64.09 -49.59 71.65 Favored 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 -179.781 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -70.44 0.15 7.21 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-O 119.499 -0.286 . . . . 0.0 111.536 -178.68 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 21.8 mt -102.91 -46.72 10.83 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.195 0 N-CA-C 109.899 -0.408 . . . . 0.0 109.899 178.895 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 1.1 ttpm? -93.19 -30.35 15.26 Favored 'General case' 0 C--N 1.343 0.318 0 N-CA-C 112.25 0.463 . . . . 0.0 112.25 -176.078 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 49.5 mm-40 -86.46 -30.56 21.93 Favored 'General case' 0 C--N 1.34 0.172 0 CA-C-N 118.371 0.532 . . . . 0.0 110.558 -177.72 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -73.76 -29.1 62.02 Favored 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 110.356 -0.239 . . . . 0.0 110.356 -179.323 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 19.1 m80 59.57 57.73 3.16 Favored 'General case' 0 C--N 1.346 0.426 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 -179.481 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 9.2 p90 . . . . . 0 C--N 1.319 -0.739 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.896 -178.631 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.221 -0.406 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 28.9 mtpp -58.51 -64.92 0.75 Allowed 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 122.492 0.317 . . . . 0.0 110.757 -178.763 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -58.9 -44.85 91.28 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.64 -0.254 . . . . 0.0 110.623 -179.379 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 53.5 t -56.53 -45.2 82.07 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 179.577 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.6 -45.09 91.92 Favored 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 110.397 -0.224 . . . . 0.0 110.397 -179.74 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 34.9 mtmm -58.55 -41.49 85.71 Favored 'General case' 0 C--N 1.341 0.237 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 178.512 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.43 -35.23 76.98 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 108.748 -0.834 . . . . 0.0 108.748 177.911 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -88.58 15.64 7.76 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.471 178.458 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 64.2 t30 85.26 145.91 0.06 Allowed 'General case' 0 C--N 1.353 0.738 0 C-N-CA 124.281 1.032 . . . . 0.0 111.487 177.74 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 4.9 t 65.24 -116.6 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.471 0 CA-C-N 114.907 -1.042 . . . . 0.0 109.814 178.461 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 7.9 t -166.25 -161.69 0.49 Allowed 'General case' 0 C--N 1.344 0.341 0 CA-C-N 118.491 0.587 . . . . 0.0 110.247 -178.758 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 39.1 p -54.26 -23.32 14.41 Favored 'General case' 0 C--N 1.342 0.261 0 C-N-CA 123.189 0.596 . . . . 0.0 111.744 -177.881 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 13.2 t -56.2 -38.53 71.11 Favored 'General case' 0 C--O 1.222 -0.385 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 179.257 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 58.0 m -65.72 -35.32 80.42 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 109.922 -0.399 . . . . 0.0 109.922 179.767 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 62.3 t -69.98 -52.71 28.48 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.336 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 179.868 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 85.3 p -53.42 -40.31 65.02 Favored 'General case' 0 C--N 1.343 0.298 0 N-CA-C 110.524 -0.176 . . . . 0.0 110.524 -178.634 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 57.7 m170 -54.05 -36.41 63.04 Favored 'General case' 0 C--N 1.345 0.386 0 C-N-CA 122.27 0.228 . . . . 0.0 110.396 179.112 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 59.2 t -78.49 -35.02 18.57 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.224 0 CA-C-N 116.687 -0.233 . . . . 0.0 110.397 -179.288 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 25.5 mm -67.23 -50.84 59.4 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.218 0 CA-C-N 117.889 0.313 . . . . 0.0 110.214 -179.285 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 34.6 p30 -87.27 -8.67 56.52 Favored 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 111.674 0.25 . . . . 0.0 111.674 -177.645 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 54.25 36.75 25.84 Favored 'General case' 0 C--N 1.345 0.399 0 C-N-CA 122.616 0.367 . . . . 0.0 110.388 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 7.0 t -82.12 -30.1 31.34 Favored 'General case' 0 CA--C 1.531 0.247 0 N-CA-C 110.307 -0.257 . . . . 0.0 110.307 -179.291 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 60.1 mtp85 -128.31 116.95 20.61 Favored 'General case' 0 C--N 1.344 0.344 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 47.4 t80 -71.72 108.38 5.02 Favored 'General case' 0 N--CA 1.453 -0.285 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 -179.668 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 4.6 m -107.35 38.55 0.37 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.376 0 C-N-CA 122.551 0.341 . . . . 0.0 110.549 -178.96 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 60.73 -179.91 0.1 Allowed 'General case' 0 C--N 1.343 0.302 0 CA-C-O 121.111 0.482 . . . . 0.0 111.179 178.869 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 58.1 mm-40 -77.77 -25.64 49.23 Favored 'General case' 0 C--O 1.223 -0.298 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.286 179.693 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -58.3 -64.92 0.75 Allowed 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 110.471 -0.196 . . . . 0.0 110.471 -178.666 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 2.2 m -61.26 -44.29 97.48 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 110.091 -0.337 . . . . 0.0 110.091 -178.674 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 44.1 ttm105 -53.54 -55.8 22.49 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 122.826 0.451 . . . . 0.0 110.613 -179.336 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -63.36 -48.03 79.65 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 122.424 0.289 . . . . 0.0 110.496 -178.873 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.65 -47.32 70.46 Favored 'General case' 0 C--N 1.34 0.157 0 C-N-CA 122.187 0.195 . . . . 0.0 110.674 -178.972 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 37.9 t -62.78 -57.41 12.16 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.223 0 N-CA-C 110.173 -0.306 . . . . 0.0 110.173 -179.484 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 13.1 m95 -56.57 -32.13 64.89 Favored 'General case' 0 C--N 1.343 0.283 0 CA-C-N 117.463 0.119 . . . . 0.0 110.946 -178.235 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -71.59 -67.48 0.52 Allowed 'General case' 0 N--CA 1.447 -0.581 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 179.075 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -48.08 -40.54 23.58 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 122.692 0.397 . . . . 0.0 111.555 -178.11 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 1.5 mm -44.71 -54.4 1.23 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.206 0 C-N-CA 123.095 0.558 . . . . 0.0 111.27 -178.326 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 24.3 pttm -100.84 -31.78 10.99 Favored 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 112.187 0.44 . . . . 0.0 112.187 -176.112 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 76.1 mm-40 -73.5 -40.19 64.25 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 118.04 0.382 . . . . 0.0 110.989 -176.989 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.0 tt -77.33 -36.43 53.93 Favored 'General case' 0 CA--C 1.527 0.084 0 N-CA-C 110.179 -0.304 . . . . 0.0 110.179 -178.688 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 15.2 m80 76.93 134.28 0.06 Allowed 'General case' 0 C--N 1.346 0.444 0 C-N-CA 123.619 0.768 . . . . 0.0 109.735 -178.975 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 3.7 p90 . . . . . 0 CA--C 1.532 0.272 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 178.301 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.224 -0.286 0 N-CA-C 110.246 -0.279 . . . . 0.0 110.246 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 58.2 mtmt -48.43 -63.05 1.19 Allowed 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 122.947 0.499 . . . . 0.0 110.583 179.41 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -58.38 -44.97 89.15 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.722 -178.45 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 97.1 t -57.12 -43.34 81.27 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.184 0 N-CA-C 110.319 -0.252 . . . . 0.0 110.319 -179.168 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.71 -40.08 93.78 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 122.386 0.275 . . . . 0.0 110.715 -178.702 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -64.65 -49.32 71.47 Favored 'General case' 0 C--O 1.227 -0.125 0 N-CA-C 109.521 -0.548 . . . . 0.0 109.521 179.447 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.38 -31.76 73.1 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.258 179.844 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -71.41 -53.22 14.79 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 122.241 0.216 . . . . 0.0 110.635 -178.987 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 42.7 t30 -147.94 -82.65 0.12 Allowed 'General case' 0 C--N 1.342 0.264 0 CA-C-O 119.682 -0.199 . . . . 0.0 111.06 -177.851 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 95.2 t -140.68 -66.87 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.348 0.514 0 CA-C-N 117.68 0.218 . . . . 0.0 110.911 -176.958 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 74.4 m -132.43 172.48 12.42 Favored 'General case' 0 C--N 1.344 0.365 0 CA-C-O 120.995 0.426 . . . . 0.0 110.892 -176.999 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 43.0 p -53.91 -31.72 51.04 Favored 'General case' 0 C--O 1.223 -0.314 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.438 -178.696 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 12.8 t -49.4 -44.8 45.45 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 122.099 0.159 . . . . 0.0 110.936 -178.992 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 6.6 m -57.52 -28.83 63.82 Favored 'General case' 0 C--N 1.342 0.281 0 CA-C-O 119.687 -0.197 . . . . 0.0 111.116 -178.756 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 40.2 t -88.33 -37.08 9.99 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.223 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 179.098 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 25.4 m -57.08 -45.86 82.97 Favored 'General case' 0 CA--C 1.519 -0.233 0 C-N-CA 122.474 0.31 . . . . 0.0 110.473 -177.347 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 52.9 m-70 -56.13 -43.16 77.93 Favored 'General case' 0 C--O 1.209 -1.064 0 N-CA-C 110.177 -0.305 . . . . 0.0 110.177 -179.497 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 3.2 t -58.27 -29.5 37.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 O-C-N 121.9 -0.5 . . . . 0.0 112.325 -176.204 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 2.7 mt -79.85 -29.41 12.89 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.462 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 -176.239 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 6.4 p30 -117.37 -33.7 4.54 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 118.613 0.642 . . . . 0.0 112.168 -175.488 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 174.08 102.9 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 -177.521 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 65.5 p -48.83 -33.34 10.32 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 112.722 0.638 . . . . 0.0 112.722 -177.609 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 74.68 -164.0 0.08 Allowed 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 -177.148 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.1 t80 -79.24 96.14 5.84 Favored 'General case' 0 CA--C 1.531 0.232 0 O-C-N 122.249 -0.282 . . . . 0.0 110.779 -178.209 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 1.6 m -149.22 151.21 13.2 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.236 0 N-CA-C 108.576 -0.898 . . . . 0.0 108.576 176.9 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.88 153.66 42.99 Favored 'General case' 0 N--CA 1.447 -0.605 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 178.855 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 38.3 mp0 -55.21 -34.09 63.64 Favored 'General case' 0 CA--C 1.527 0.088 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 179.589 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -53.84 -41.84 67.84 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 122.66 0.384 . . . . 0.0 110.804 -179.857 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 1.7 m -66.22 -22.73 66.35 Favored 'General case' 0 C--N 1.346 0.432 0 N-CA-C 110.234 -0.284 . . . . 0.0 110.234 -178.202 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 3.0 mmp_? -85.07 -47.03 10.59 Favored 'General case' 0 C--N 1.343 0.312 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 179.762 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 28.2 m120 -54.19 -43.66 70.91 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 179.51 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -58.02 -41.61 83.51 Favored 'General case' 0 N--CA 1.453 -0.307 0 O-C-N 123.165 0.291 . . . . 0.0 111.317 -179.523 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 38.4 t -66.16 -57.17 11.5 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.195 0 CA-C-N 117.609 0.186 . . . . 0.0 110.551 -177.919 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 33.9 m95 -65.45 -30.77 71.6 Favored 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 110.719 -0.104 . . . . 0.0 110.719 -177.315 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -67.24 -51.12 57.05 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 177.505 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.23 -41.55 84.36 Favored 'General case' 0 C--N 1.342 0.266 0 C-N-CA 122.362 0.265 . . . . 0.0 110.334 179.74 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 3.2 mm -54.39 -50.82 54.53 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.272 0 C-N-CA 122.788 0.435 . . . . 0.0 110.315 179.782 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 20.4 tptm -74.11 -33.16 63.49 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 110.243 -0.28 . . . . 0.0 110.243 -178.014 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -63.96 -63.35 1.18 Allowed 'General case' 0 N--CA 1.448 -0.539 0 C-N-CA 122.368 0.267 . . . . 0.0 110.947 -177.61 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 82.3 mt -83.49 -20.79 33.32 Favored 'General case' 0 C--N 1.338 0.088 0 CA-C-O 119.47 -0.3 . . . . 0.0 111.503 -176.768 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 73.87 138.47 0.06 Allowed 'General case' 0 C--N 1.345 0.407 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 -178.279 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 8.7 t80 . . . . . 0 C--N 1.333 -0.126 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 179.487 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 33.9 pt . . . . . 0 N--CA 1.443 -0.776 0 N-CA-C 109.673 -0.491 . . . . 0.0 109.673 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 36.5 mtpt -65.71 -63.11 1.17 Allowed 'General case' 0 N--CA 1.448 -0.536 0 N-CA-C 109.549 -0.537 . . . . 0.0 109.549 179.903 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -49.41 -49.83 43.19 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.447 178.843 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 64.4 t -58.78 -51.75 68.33 Favored 'Isoleucine or valine' 0 C--N 1.341 0.224 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.299 -179.239 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -55.6 -54.56 42.62 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 122.28 0.232 . . . . 0.0 110.64 -178.726 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 61.9 mtpt -58.83 -38.85 79.61 Favored 'General case' 0 N--CA 1.453 -0.283 0 O-C-N 123.113 0.258 . . . . 0.0 110.457 -178.371 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 14.1 tpt180 -63.41 -36.82 84.98 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 177.701 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -82.75 7.86 13.83 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 122.417 0.287 . . . . 0.0 110.241 177.862 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 76.53 -35.79 0.25 Allowed 'General case' 0 C--N 1.35 0.591 0 C-N-CA 124.144 0.977 . . . . 0.0 111.888 177.823 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.416 HG23 ' H ' ' A' ' 13' ' ' VAL . 0.0 OUTLIER -78.05 -170.99 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 CA-C-N 118.321 0.509 . . . . 0.0 110.384 -178.003 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 11.2 t -102.93 179.78 4.18 Favored 'General case' 0 C--N 1.345 0.372 0 C-N-CA 122.824 0.45 . . . . 0.0 110.439 -178.468 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 19.4 p -58.02 -29.21 65.14 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 123.106 0.562 . . . . 0.0 111.644 -177.372 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 12.5 t -53.91 -38.23 64.62 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 117.814 0.279 . . . . 0.0 110.667 -179.298 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' THR . . . . . 0.522 ' O ' HG23 ' A' ' 21' ' ' VAL . 87.2 m -67.4 -36.68 81.78 Favored 'General case' 0 N--CA 1.451 -0.393 0 O-C-N 122.168 -0.332 . . . . 0.0 110.152 -179.361 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 66.7 t -73.96 -41.02 53.0 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 N-CA-C 109.931 -0.396 . . . . 0.0 109.931 -179.62 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 94.0 p -59.88 -41.31 91.28 Favored 'General case' 0 N--CA 1.453 -0.278 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 179.021 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 55.2 m170 -56.5 -35.45 68.03 Favored 'General case' 0 C--N 1.346 0.436 0 N-CA-C 110.085 -0.339 . . . . 0.0 110.085 177.827 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.549 HG22 ' HD2' ' A' ' 33' ' ' ARG . 99.4 t -72.94 -57.79 6.27 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.162 0 C-N-CA 122.376 0.27 . . . . 0.0 110.68 -177.714 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 34.2 mm -57.0 -48.46 81.69 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.157 0 N-CA-C 110.368 -0.234 . . . . 0.0 110.368 -177.509 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 34.9 m-80 -73.8 -28.86 61.85 Favored 'General case' 0 CA--C 1.53 0.192 0 N-CA-C 110.496 -0.187 . . . . 0.0 110.496 -179.27 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 34.3 ttpt 57.01 53.72 7.72 Favored 'General case' 0 C--N 1.344 0.327 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 -179.124 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 13.9 t -108.46 -43.3 4.35 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.849 -177.432 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 27.0 tpt180 -85.54 109.66 18.67 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 109.408 -0.59 . . . . 0.0 109.408 -179.013 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 66.4 t80 -64.64 144.68 57.05 Favored 'General case' 0 N--CA 1.456 -0.149 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.268 -179.802 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 5.5 m -147.81 -171.05 0.25 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 -179.567 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -85.53 28.89 0.72 Allowed 'General case' 0 CA--C 1.539 0.526 0 CA-C-O 119.621 -0.228 . . . . 0.0 111.322 -179.325 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 72.56 -65.64 0.34 Allowed 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 123.427 0.691 . . . . 0.0 111.564 178.086 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -42.76 -47.13 5.39 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.355 0.662 . . . . 0.0 111.599 -176.872 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 6.6 m -50.48 -39.95 49.62 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 122.426 0.29 . . . . 0.0 111.026 -179.195 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' ARG . . . . . 0.549 ' HD2' HG22 ' A' ' 21' ' ' VAL . 3.4 mpt_? -82.38 -42.45 18.64 Favored 'General case' 0 N--CA 1.46 0.058 0 N-CA-C 109.992 -0.373 . . . . 0.0 109.992 -178.789 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 20.2 t30 -54.41 -43.45 71.5 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 110.014 -0.365 . . . . 0.0 110.014 179.364 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -56.98 -49.0 77.09 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 122.537 0.335 . . . . 0.0 110.272 179.858 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 84.8 t -62.85 -49.28 84.28 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 N-CA-C 109.824 -0.436 . . . . 0.0 109.824 179.998 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 18.4 m95 -53.84 -40.27 66.31 Favored 'General case' 0 C--N 1.341 0.236 0 N-CA-C 110.05 -0.352 . . . . 0.0 110.05 179.767 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -66.55 -47.59 72.36 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 178.41 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -53.75 -39.57 65.45 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 122.425 0.29 . . . . 0.0 110.974 -179.482 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 1.1 mp -53.69 -39.75 39.84 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.384 0 N-CA-C 110.231 -0.285 . . . . 0.0 110.231 179.792 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 57.4 tptt -86.71 -40.25 15.23 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 122.244 0.218 . . . . 0.0 110.744 -177.328 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 47.2 mm-40 -61.68 -51.8 66.94 Favored 'General case' 0 N--CA 1.456 -0.175 0 N-CA-C 110.04 -0.355 . . . . 0.0 110.04 -177.696 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 61.3 tp -83.78 -82.54 0.16 Allowed 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 179.571 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 2.5 p-80 161.8 145.31 0.01 OUTLIER 'General case' 0 C--N 1.345 0.372 0 C-N-CA 124.24 1.016 . . . . 0.0 108.589 -179.835 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 29.5 t80 . . . . . 0 C--N 1.329 -0.294 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 178.887 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 20.2 tt . . . . . 0 C--O 1.223 -0.304 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 9.0 mtmp? -59.75 -65.84 0.61 Allowed 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 122.575 0.35 . . . . 0.0 110.125 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -54.96 -51.3 66.61 Favored 'General case' 0 N--CA 1.456 -0.147 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.513 -178.698 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 55.0 t -55.99 -49.86 72.92 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 C-N-CA 122.658 0.383 . . . . 0.0 110.643 -178.196 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.0 -50.47 70.61 Favored 'General case' 0 N--CA 1.456 -0.168 0 C-N-CA 122.175 0.19 . . . . 0.0 111.186 -177.743 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 41.9 tttm -62.08 -36.03 80.46 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 122.071 0.149 . . . . 0.0 110.624 -178.024 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 21.7 tpp180 -72.44 -41.25 66.36 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 109.754 -0.462 . . . . 0.0 109.754 179.588 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -64.89 -57.42 8.85 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 122.541 0.337 . . . . 0.0 111.129 -178.384 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 22.1 m120 -135.74 -121.36 0.16 Allowed 'General case' 0 C--N 1.342 0.253 0 N-CA-C 110.299 -0.26 . . . . 0.0 110.299 -177.22 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 94.5 t -87.69 -58.8 3.17 Favored 'Isoleucine or valine' 0 C--N 1.342 0.266 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 -178.351 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 52.4 p -167.48 -164.04 0.56 Allowed 'General case' 0 C--O 1.232 0.155 0 N-CA-C 109.912 -0.403 . . . . 0.0 109.912 -179.06 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 27.9 m -56.88 -27.39 60.45 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.557 179.914 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 23.5 p -59.79 -54.56 44.81 Favored 'General case' 0 C--N 1.341 0.236 0 N-CA-C 110.068 -0.345 . . . . 0.0 110.068 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -62.57 -20.91 65.17 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-O 119.52 -0.276 . . . . 0.0 111.084 -179.337 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 39.4 t -82.04 -53.27 12.29 Favored 'Isoleucine or valine' 0 C--N 1.34 0.178 0 CA-C-N 118.028 0.377 . . . . 0.0 110.035 179.272 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 84.2 p -50.87 -38.42 49.35 Favored 'General case' 0 C--N 1.342 0.268 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 -179.325 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 58.1 m170 -50.22 -39.82 45.58 Favored 'General case' 0 CA--C 1.529 0.166 0 O-C-N 123.266 0.353 . . . . 0.0 110.227 178.344 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 3.7 t -84.81 -53.97 9.65 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.167 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.032 -178.679 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 31.6 mm -55.22 -50.33 65.25 Favored 'Isoleucine or valine' 0 C--N 1.343 0.307 0 O-C-N 122.797 0.061 . . . . 0.0 110.918 -175.788 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 25.5 t30 -82.42 -3.2 55.21 Favored 'General case' 0 CA--C 1.533 0.305 0 N-CA-C 110.175 -0.306 . . . . 0.0 110.175 -178.498 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 52.8 mtmt 55.19 37.82 29.48 Favored 'General case' 0 C--N 1.347 0.466 0 N-CA-C 108.839 -0.801 . . . . 0.0 108.839 -178.294 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.9 -32.47 73.74 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 115.567 -0.742 . . . . 0.0 109.885 -178.877 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 15.6 ptp180 -157.48 145.05 18.69 Favored 'General case' 0 N--CA 1.452 -0.362 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 179.007 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 30.8 t80 -79.66 92.12 5.33 Favored 'General case' 0 N--CA 1.455 -0.214 0 N-CA-C 109.752 -0.462 . . . . 0.0 109.752 -178.812 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 11.7 m -72.75 163.58 3.88 Favored 'Isoleucine or valine' 0 C--O 1.233 0.22 0 N-CA-C 109.92 -0.4 . . . . 0.0 109.92 178.845 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -65.35 157.03 30.32 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 178.142 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -53.92 -38.02 64.42 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 122.575 0.35 . . . . 0.0 110.415 -179.946 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -68.14 -12.4 60.84 Favored 'General case' 0 CA--C 1.538 0.518 0 N-CA-C 112.172 0.434 . . . . 0.0 112.172 -177.432 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -94.67 -52.31 4.34 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 118.343 0.52 . . . . 0.0 109.9 179.546 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 6.6 ptm180 -69.45 -35.28 75.49 Favored 'General case' 0 CA--C 1.53 0.2 0 N-CA-C 112.02 0.378 . . . . 0.0 112.02 -176.645 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 43.2 p-10 -57.59 -38.62 75.2 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 118.202 0.456 . . . . 0.0 110.162 -179.214 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.41 -43.09 91.64 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 110.32 -0.252 . . . . 0.0 110.32 -179.86 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 87.4 t -60.51 -59.66 3.81 Favored 'Isoleucine or valine' 0 C--N 1.339 0.15 0 N-CA-C 110.105 -0.332 . . . . 0.0 110.105 -179.466 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 52.5 m95 -60.47 -37.28 80.52 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 116.718 -0.219 . . . . 0.0 110.942 -177.549 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -63.49 -58.2 7.77 Favored 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 178.895 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -52.39 -45.17 65.71 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 122.304 0.242 . . . . 0.0 110.766 -178.745 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 36.1 mt -54.7 -30.13 21.98 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 C-N-CA 122.245 0.218 . . . . 0.0 111.041 -179.437 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 7.7 mtpm? -85.11 -53.61 5.16 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 110.047 -0.353 . . . . 0.0 110.047 -178.676 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -63.98 -55.86 19.32 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.657 -175.425 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -73.87 -3.23 27.56 Favored 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 179.556 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 37.0 p-80 40.62 84.18 0.02 OUTLIER 'General case' 0 C--N 1.353 0.741 0 C-N-CA 124.036 0.934 . . . . 0.0 111.556 179.291 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 13.3 t80 . . . . . 0 N--CA 1.456 -0.154 0 CA-C-N 115.527 -0.76 . . . . 0.0 109.166 178.963 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 19.5 tt . . . . . 0 N--CA 1.462 0.174 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 26.7 mmtp -67.35 -62.96 1.17 Allowed 'General case' 0 N--CA 1.445 -0.69 0 C-N-CA 122.785 0.434 . . . . 0.0 110.962 -179.425 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 65.7 m-20 -69.04 -42.83 75.82 Favored 'General case' 0 N--CA 1.461 0.105 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.798 -175.764 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.522 HG23 ' H ' ' A' ' 8' ' ' ALA . 18.7 m -53.31 -56.6 7.55 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.191 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 -179.905 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.522 ' H ' HG23 ' A' ' 7' ' ' VAL . . . -59.12 -45.88 89.78 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 122.988 0.515 . . . . 0.0 110.857 179.419 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 2.0 ttmp? -53.57 -49.74 67.05 Favored 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 110.178 -0.305 . . . . 0.0 110.178 -179.101 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 57.6 ttt85 -71.67 -37.81 70.72 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 122.371 0.268 . . . . 0.0 110.645 -179.007 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -60.53 -40.17 90.55 Favored 'General case' 0 N--CA 1.456 -0.168 0 C-N-CA 122.257 0.223 . . . . 0.0 110.793 -178.595 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 23.8 t-20 -140.79 -88.36 0.17 Allowed 'General case' 0 C--N 1.343 0.325 0 N-CA-C 110.461 -0.2 . . . . 0.0 110.461 -179.418 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 71.5 t -139.47 -57.35 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.345 0.38 0 N-CA-C 109.835 -0.432 . . . . 0.0 109.835 -178.266 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 67.1 m -152.44 176.34 11.77 Favored 'General case' 0 C--N 1.344 0.339 0 N-CA-C 109.872 -0.418 . . . . 0.0 109.872 -179.342 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 17.2 p -63.52 -20.59 65.74 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.103 -179.637 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 14.9 t -53.79 -38.82 64.89 Favored 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 109.999 -0.371 . . . . 0.0 109.999 179.601 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 18.0 m -61.47 -42.47 98.83 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 109.819 -0.438 . . . . 0.0 109.819 179.463 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 20.6 t -65.72 -35.63 75.65 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.14 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 179.356 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 23.1 t -65.28 -43.59 90.69 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 72.7 m-70 -64.16 -43.22 95.85 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.285 179.38 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 16.2 t -55.72 -47.17 79.58 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.28 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 179.123 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 60.3 mt -61.63 -48.46 88.66 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 29.4 m-80 -75.28 -9.97 59.04 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 122.167 0.187 . . . . 0.0 111.119 -179.245 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 4.8 tmtp? 62.38 42.97 8.51 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 122.893 0.477 . . . . 0.0 110.012 -179.881 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -98.24 -84.4 0.39 Allowed 'General case' 0 C--N 1.344 0.357 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 179.762 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 67.1 mtp180 -97.11 120.5 37.58 Favored 'General case' 0 N--CA 1.456 -0.126 0 N-CA-C 109.496 -0.557 . . . . 0.0 109.496 -179.792 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 29.2 p90 -149.77 120.78 7.7 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 179.234 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 3.8 t -81.76 75.97 0.96 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.396 0 N-CA-C 107.856 -1.164 . . . . 0.0 107.856 179.048 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 65.11 -178.89 0.18 Allowed 'General case' 0 C--O 1.236 0.348 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.094 -178.352 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 -65.29 -25.1 67.49 Favored 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 110.214 -0.291 . . . . 0.0 110.214 -179.197 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -52.09 -39.13 59.31 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 122.565 0.346 . . . . 0.0 110.813 179.438 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 99.0 m -59.07 -67.41 0.37 Allowed 'General case' 0 C--N 1.343 0.287 0 N-CA-C 110.439 -0.208 . . . . 0.0 110.439 -179.581 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 9.9 ptm180 -56.5 -39.13 72.77 Favored 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 110.581 -0.155 . . . . 0.0 110.581 -177.836 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -59.7 -57.39 13.12 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 110.305 -0.257 . . . . 0.0 110.305 -179.443 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -59.81 -42.25 93.06 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 122.429 0.292 . . . . 0.0 110.649 -179.102 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 21.3 t -58.39 -61.13 1.5 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.2 0 C-N-CA 122.365 0.266 . . . . 0.0 110.324 -179.216 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 19.5 m95 -61.63 -38.22 86.86 Favored 'General case' 0 N--CA 1.455 -0.177 0 N-CA-C 110.687 -0.116 . . . . 0.0 110.687 -178.145 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -59.65 -51.42 69.89 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 109.863 -0.421 . . . . 0.0 109.863 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -61.38 -46.94 88.1 Favored 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 122.29 0.236 . . . . 0.0 110.64 -179.38 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 55.5 mt -58.18 -41.83 81.82 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.295 0 C-N-CA 122.229 0.211 . . . . 0.0 110.496 -179.22 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 37.6 ttmt -74.2 -38.81 63.5 Favored 'General case' 0 N--CA 1.45 -0.449 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 -178.067 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -62.66 -52.83 61.78 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-N 116.564 -0.289 . . . . 0.0 110.455 -178.153 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 10.2 mp -79.24 -18.16 53.38 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-O 119.554 -0.26 . . . . 0.0 110.47 -179.061 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 22.2 m80 76.17 137.62 0.06 Allowed 'General case' 0 C--N 1.348 0.509 0 C-N-CA 123.871 0.868 . . . . 0.0 110.966 178.299 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 8.1 t80 . . . . . 0 CA--C 1.529 0.158 0 N-CA-C 108.466 -0.939 . . . . 0.0 108.466 178.729 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 7.1 tt . . . . . 0 CA--C 1.547 0.85 0 N-CA-C 111.836 0.31 . . . . 0.0 111.836 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 15.6 tppt? -48.01 -70.26 0.1 Allowed 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 123.552 0.741 . . . . 0.0 112.293 -178.11 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 69.1 m-20 -63.07 -40.19 96.95 Favored 'General case' 0 C--O 1.221 -0.399 0 CA-C-O 119.787 -0.149 . . . . 0.0 110.711 -175.579 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.431 HG23 ' CD2' ' A' ' 45' ' ' TYR . 2.4 t -52.17 -46.35 43.86 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.175 0 C-N-CA 122.166 0.187 . . . . 0.0 110.785 -179.111 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -52.61 -61.36 2.33 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 110.584 -0.154 . . . . 0.0 110.584 -178.578 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -68.38 -28.21 66.91 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-O 119.791 -0.147 . . . . 0.0 111.347 -177.929 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 1.6 tpm_? -62.01 -48.0 82.23 Favored 'General case' 0 C--N 1.339 0.146 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 179.212 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -78.49 -1.07 32.01 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 110.068 -0.345 . . . . 0.0 110.068 178.033 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 58.6 t30 61.13 48.06 6.67 Favored 'General case' 0 C--N 1.348 0.501 0 C-N-CA 123.613 0.765 . . . . 0.0 110.828 178.8 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 30.3 m -146.43 148.01 17.45 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.221 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 177.671 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 69.2 m -63.91 154.76 32.85 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 109.762 -0.459 . . . . 0.0 109.762 179.604 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 15.0 t -53.81 -32.72 53.76 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 116.576 -0.283 . . . . 0.0 110.364 179.484 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 3.7 m -57.07 -43.0 81.66 Favored 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 178.891 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 6.1 m -63.06 -40.79 98.72 Favored 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 179.527 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 47.1 t -64.05 -39.05 84.07 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.238 0 N-CA-C 109.333 -0.618 . . . . 0.0 109.333 179.417 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 10.0 t -55.99 -37.64 69.38 Favored 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 110.129 -0.323 . . . . 0.0 110.129 179.337 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 43.0 m170 -61.27 -33.61 73.83 Favored 'General case' 0 C--N 1.341 0.237 0 N-CA-C 110.261 -0.274 . . . . 0.0 110.261 179.704 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 90.8 t -74.56 -41.41 48.8 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.099 0 C-N-CA 122.182 0.193 . . . . 0.0 110.886 -178.969 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 72.4 mt -49.23 -55.05 4.52 Favored 'Isoleucine or valine' 0 C--N 1.343 0.298 0 C-N-CA 122.297 0.239 . . . . 0.0 110.958 -176.828 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 5.8 p30 -104.8 13.31 31.51 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 117.558 0.163 . . . . 0.0 110.825 -178.36 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 65.1 mttt 46.9 58.57 4.63 Favored 'General case' 0 C--N 1.346 0.421 0 C-N-CA 122.829 0.452 . . . . 0.0 110.64 179.268 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -72.49 -65.98 0.72 Allowed 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 -179.528 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 84.1 mtt85 -94.04 129.06 40.7 Favored 'General case' 0 C--N 1.342 0.274 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 -179.608 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -77.14 111.12 12.41 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 109.37 -0.604 . . . . 0.0 109.37 179.942 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 9.5 m -110.03 43.31 0.27 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 CA-C-N 115.806 -0.633 . . . . 0.0 109.479 -178.881 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.416 ' C ' ' H ' ' A' ' 31' ' ' GLU . . . 54.79 22.69 4.34 Favored 'General case' 0 C--N 1.345 0.379 0 C-N-CA 123.565 0.746 . . . . 0.0 112.16 178.52 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 70.6 mm-40 65.82 -26.65 0.1 Allowed 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 124.052 0.941 . . . . 0.0 113.096 178.661 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.416 ' H ' ' C ' ' A' ' 29' ' ' ALA . 40.8 tt0 -48.11 -58.93 3.82 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 118.547 0.612 . . . . 0.0 110.879 -178.528 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 7.9 m -64.64 -39.63 94.03 Favored 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 110.744 -0.095 . . . . 0.0 110.744 -178.512 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 92.2 mtt180 -57.97 -52.89 63.63 Favored 'General case' 0 CA--C 1.533 0.299 0 N-CA-C 110.129 -0.323 . . . . 0.0 110.129 -179.327 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -63.72 -37.95 89.27 Favored 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 110.066 -0.346 . . . . 0.0 110.066 -179.232 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -60.63 -42.54 97.11 Favored 'General case' 0 C--N 1.341 0.205 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 179.051 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 20.6 t -65.59 -45.08 93.39 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 179.014 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 15.4 m95 -61.63 -33.75 74.47 Favored 'General case' 0 CA--C 1.531 0.244 0 N-CA-C 109.895 -0.409 . . . . 0.0 109.895 179.145 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -67.58 -42.96 81.7 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 109.033 -0.728 . . . . 0.0 109.033 177.365 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.64 -38.67 78.61 Favored 'General case' 0 C--N 1.345 0.393 0 N-CA-C 110.001 -0.37 . . . . 0.0 110.001 178.884 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -54.65 -44.88 71.65 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 179.367 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 15.0 mttm -94.99 12.55 28.05 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-O 119.655 -0.212 . . . . 0.0 111.313 -178.467 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -79.32 -48.86 13.36 Favored 'General case' 0 N--CA 1.456 -0.168 0 N-CA-C 108.647 -0.872 . . . . 0.0 108.647 178.917 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -92.99 -94.03 0.15 Allowed 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 178.709 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 99.7 m-70 -159.79 26.41 0.18 Allowed 'General case' 0 C--N 1.343 0.286 0 C-N-CA 123.232 0.613 . . . . 0.0 109.533 -178.322 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.431 ' CD2' HG23 ' A' ' 7' ' ' VAL . 2.5 m-85 . . . . . 0 C--N 1.332 -0.186 0 CA-C-O 120.989 0.423 . . . . 0.0 110.036 -177.931 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.468 0.465 0 N-CA-C 110.429 -0.212 . . . . 0.0 110.429 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -66.97 -66.03 0.61 Allowed 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 122.568 0.347 . . . . 0.0 110.252 -179.812 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 91.3 m-20 -65.55 -39.0 91.23 Favored 'General case' 0 C--O 1.227 -0.084 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 84.7 t -55.52 -44.25 75.57 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.235 0 C-N-CA 122.673 0.389 . . . . 0.0 110.176 -179.487 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -57.6 -47.07 83.16 Favored 'General case' 0 C--N 1.34 0.187 0 C-N-CA 122.044 0.137 . . . . 0.0 110.707 -179.294 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 6.3 mmmm -67.09 -41.12 86.84 Favored 'General case' 0 N--CA 1.457 -0.089 0 N-CA-C 109.773 -0.454 . . . . 0.0 109.773 179.912 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 45.0 ttt85 -59.52 -35.79 74.86 Favored 'General case' 0 N--CA 1.452 -0.351 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 179.131 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -75.89 -56.93 4.2 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 110.029 -0.359 . . . . 0.0 110.029 179.556 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -164.15 -93.73 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 119.82 -0.133 . . . . 0.0 111.276 -179.151 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 5.0 m -97.94 -118.63 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 C-N-CA 122.232 0.213 . . . . 0.0 110.867 -176.248 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 89.5 p -105.98 -175.09 2.7 Favored 'General case' 0 C--N 1.344 0.36 0 C-N-CA 122.621 0.368 . . . . 0.0 110.327 -176.981 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 76.8 p -55.83 -23.83 32.81 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.215 -178.398 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.4 HG23 ' N ' ' A' ' 17' ' ' THR . 13.2 t -51.62 -44.83 63.05 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 117.724 0.238 . . . . 0.0 110.426 -179.898 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' THR . . . . . 0.4 ' N ' HG23 ' A' ' 16' ' ' THR . 2.4 m -64.92 -47.91 76.04 Favored 'General case' 0 C--N 1.341 0.219 0 N-CA-C 110.301 -0.259 . . . . 0.0 110.301 -179.453 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 54.6 t -58.4 -44.84 89.52 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.169 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 -179.47 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 56.3 m -60.91 -45.81 93.18 Favored 'General case' 0 C--O 1.22 -0.496 0 N-CA-C 110.013 -0.365 . . . . 0.0 110.013 179.489 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 34.7 m170 -58.31 -41.58 84.78 Favored 'General case' 0 C--N 1.339 0.148 0 N-CA-C 110.292 -0.262 . . . . 0.0 110.292 -179.608 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 42.4 t -65.88 -55.93 17.17 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.257 0 O-C-N 123.085 0.241 . . . . 0.0 110.688 -178.939 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 92.6 mt -64.02 -53.34 45.12 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 N-CA-C 110.299 -0.26 . . . . 0.0 110.299 -177.69 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 19.4 t-20 -62.32 -30.66 71.31 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 122.624 0.37 . . . . 0.0 110.581 -179.237 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 41.2 tttp 71.45 53.09 0.23 Allowed 'General case' 0 C--N 1.344 0.342 0 C-N-CA 122.915 0.486 . . . . 0.0 109.735 179.816 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 26.6 p -75.71 -64.57 1.05 Allowed 'General case' 0 C--N 1.34 0.154 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 179.39 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 48.6 ttp85 -128.89 134.23 48.2 Favored 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 179.629 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 54.6 p90 -64.85 143.19 58.11 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 179.749 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 30.1 m -110.27 170.42 3.28 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.147 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 179.529 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -80.3 51.35 1.4 Allowed 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 122.402 0.281 . . . . 0.0 111.213 -177.728 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 63.79 -68.68 0.09 Allowed 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.249 1.02 . . . . 0.0 112.746 177.835 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 56.5 mm-40 -37.4 -53.5 1.12 Allowed 'General case' 0 C--N 1.34 0.162 0 C-N-CA 123.729 0.812 . . . . 0.0 112.076 -175.042 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 8.2 m -60.05 -52.04 67.07 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 116.983 -0.098 . . . . 0.0 111.015 -177.47 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 11.8 ttp85 -60.89 -47.47 86.24 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 122.26 0.224 . . . . 0.0 110.64 -178.58 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 20.5 m-80 -61.69 -41.18 97.22 Favored 'General case' 0 N--CA 1.456 -0.158 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 -179.788 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -60.79 -40.62 93.3 Favored 'General case' 0 C--N 1.34 0.185 0 N-CA-C 110.158 -0.312 . . . . 0.0 110.158 179.852 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 38.0 t -64.09 -53.79 39.39 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.199 0 N-CA-C 109.6 -0.518 . . . . 0.0 109.6 179.439 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 13.5 m95 -59.82 -33.92 72.39 Favored 'General case' 0 C--O 1.233 0.229 0 N-CA-C 110.615 -0.143 . . . . 0.0 110.615 -179.202 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -70.37 -57.85 4.38 Favored 'General case' 0 C--O 1.224 -0.286 0 N-CA-C 109.789 -0.449 . . . . 0.0 109.789 179.401 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -50.09 -44.19 51.81 Favored 'General case' 0 C--N 1.341 0.203 0 C-N-CA 122.94 0.496 . . . . 0.0 111.066 -179.082 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 13.8 mt -51.36 -40.92 24.62 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 C-N-CA 122.977 0.511 . . . . 0.0 111.046 -179.36 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 41.2 mttp -98.03 -20.0 17.66 Favored 'General case' 0 C--N 1.344 0.328 0 N-CA-C 111.567 0.21 . . . . 0.0 111.567 -177.13 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -73.17 -50.04 24.8 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 109.106 -0.702 . . . . 0.0 109.106 -178.089 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 51.6 tp -77.64 -92.0 0.03 OUTLIER 'General case' 0 N--CA 1.446 -0.642 0 N-CA-C 108.153 -1.054 . . . . 0.0 108.153 177.963 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 4.0 p-80 165.3 75.87 0.0 OUTLIER 'General case' 0 C--N 1.341 0.233 0 C-N-CA 123.759 0.824 . . . . 0.0 108.996 179.781 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 15.6 t80 . . . . . 0 C--N 1.325 -0.486 0 CA-C-N 116.118 -0.492 . . . . 0.0 109.776 -179.411 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.47 0.528 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 62.9 mttp -69.68 -60.97 1.98 Allowed 'General case' 0 N--CA 1.446 -0.64 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 177.586 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -63.91 -51.49 64.25 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 115.683 -0.69 . . . . 0.0 109.502 178.619 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 76.5 t -45.65 -47.1 4.79 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.225 0 C-N-CA 123.121 0.569 . . . . 0.0 111.707 -177.399 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -53.86 -62.46 1.64 Allowed 'General case' 0 C--O 1.223 -0.313 0 CA-C-N 117.511 0.142 . . . . 0.0 111.333 -177.78 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 21.7 mmmt -68.45 -44.11 75.6 Favored 'General case' 0 C--N 1.331 -0.232 0 O-C-N 122.45 -0.156 . . . . 0.0 110.988 -176.874 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 16.3 tpp180 -57.82 -39.82 78.52 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 122.568 0.347 . . . . 0.0 110.7 -178.467 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -98.22 12.86 33.26 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-O 119.562 -0.256 . . . . 0.0 110.825 -179.384 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' ASN . . . . . 0.912 ' O ' HG22 ' A' ' 13' ' ' VAL . 48.6 t30 75.52 150.83 0.12 Allowed 'General case' 0 C--N 1.35 0.589 0 C-N-CA 123.684 0.793 . . . . 0.0 110.147 179.945 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.912 HG22 ' O ' ' A' ' 12' ' ' ASN . 2.2 m 82.94 175.1 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.479 0.982 0 C-N-CA 125.679 1.591 . . . . 0.0 110.315 -179.609 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 22.4 t -96.91 -178.06 4.09 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.501 -177.623 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 19.1 p -69.0 -45.17 71.25 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.383 -179.048 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 11.9 t -56.22 -41.93 76.45 Favored 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 110.46 -0.2 . . . . 0.0 110.46 -179.121 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -65.3 -28.28 69.21 Favored 'General case' 0 CA--C 1.53 0.202 0 O-C-N 122.24 -0.287 . . . . 0.0 110.34 179.893 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 65.8 t -76.59 -37.89 30.21 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.199 0 N-CA-C 108.496 -0.927 . . . . 0.0 108.496 176.707 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 19.6 m -58.71 -33.08 69.79 Favored 'General case' 0 CA--C 1.531 0.226 0 N-CA-C 109.989 -0.374 . . . . 0.0 109.989 178.521 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 51.4 m170 -56.13 -39.35 72.1 Favored 'General case' 0 C--N 1.345 0.381 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 178.398 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 56.4 t -68.02 -46.36 81.87 Favored 'Isoleucine or valine' 0 C--N 1.341 0.211 0 N-CA-C 109.786 -0.45 . . . . 0.0 109.786 179.66 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 72.7 mt -58.87 -39.57 77.82 Favored 'Isoleucine or valine' 0 C--O 1.234 0.253 0 N-CA-C 109.835 -0.431 . . . . 0.0 109.835 -179.236 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 34.5 m-80 -93.77 15.35 16.67 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 122.369 0.267 . . . . 0.0 110.282 179.436 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 30.15 65.39 0.14 Allowed 'General case' 0 C--N 1.356 0.868 0 C-N-CA 124.376 1.07 . . . . 0.0 111.566 -179.357 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 17.4 p -104.44 -83.7 0.49 Allowed 'General case' 0 C--N 1.342 0.24 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 178.208 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 14.4 tpt180 -90.81 105.29 17.72 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 108.936 -0.764 . . . . 0.0 108.936 179.212 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 40.7 t80 -78.26 100.45 6.69 Favored 'General case' 0 N--CA 1.454 -0.227 0 N-CA-C 109.705 -0.48 . . . . 0.0 109.705 -179.738 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 4.3 t -87.28 57.4 0.17 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.42 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 -179.917 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 65.26 176.25 0.21 Allowed 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 123.233 0.613 . . . . 0.0 111.489 178.933 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 48.1 mp0 -68.9 -25.74 64.75 Favored 'General case' 0 C--O 1.219 -0.509 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.009 -179.273 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 20.6 tp10 -53.81 -60.26 3.55 Favored 'General case' 0 C--O 1.226 -0.165 0 C-N-CA 122.559 0.344 . . . . 0.0 111.263 -176.982 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 63.1 p -61.83 -44.75 96.21 Favored 'General case' 0 C--O 1.224 -0.272 0 N-CA-C 110.003 -0.369 . . . . 0.0 110.003 -178.555 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 64.7 ttp85 -56.37 -60.19 3.87 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 122.41 0.284 . . . . 0.0 111.284 -178.192 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -67.01 -39.91 87.17 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-O 119.603 -0.236 . . . . 0.0 111.08 -175.231 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -62.8 -45.13 94.06 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 117.881 0.309 . . . . 0.0 110.409 -179.777 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 20.3 t -60.63 -57.25 12.82 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.108 0 C-N-CA 122.299 0.24 . . . . 0.0 110.646 -178.802 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 14.9 m95 -60.14 -38.04 81.89 Favored 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 110.77 -0.085 . . . . 0.0 110.77 -178.151 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -63.25 -53.23 56.28 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 -179.933 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -60.3 -40.49 90.72 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-N 116.569 -0.287 . . . . 0.0 110.636 -179.139 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 14.3 mt -59.53 -44.53 93.27 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.146 0 N-CA-C 110.232 -0.284 . . . . 0.0 110.232 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 57.8 tptt -70.27 -35.28 73.65 Favored 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 -178.59 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -66.74 -52.87 39.27 Favored 'General case' 0 N--CA 1.443 -0.798 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.041 -177.98 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 10.5 mp -81.78 -21.05 38.0 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 122.348 0.259 . . . . 0.0 111.305 -177.456 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 2.4 m-70 71.73 110.66 0.06 Allowed 'General case' 0 N--CA 1.465 0.317 0 N-CA-C 108.636 -0.876 . . . . 0.0 108.636 -177.032 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 1.3 t80 . . . . . 0 C--N 1.325 -0.474 0 C-N-CA 122.83 0.452 . . . . 0.0 110.387 -176.522 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 14.8 tt . . . . . 0 N--CA 1.465 0.317 0 N-CA-C 109.802 -0.444 . . . . 0.0 109.802 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 22.3 mtmm -48.33 -68.55 0.17 Allowed 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 123.657 0.783 . . . . 0.0 111.849 -177.587 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -52.23 -58.46 6.57 Favored 'General case' 0 C--O 1.219 -0.504 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.073 -177.667 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 63.1 t -50.22 -42.4 20.17 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.398 0 O-C-N 123.001 0.188 . . . . 0.0 111.197 -176.434 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -53.38 -62.86 1.38 Allowed 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 112.019 0.377 . . . . 0.0 112.019 -177.024 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 19.0 mtpp -79.1 -38.33 36.47 Favored 'General case' 0 N--CA 1.461 0.12 0 N-CA-C 110.618 -0.142 . . . . 0.0 110.618 -176.088 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 57.5 ttm-85 -57.6 -35.26 70.2 Favored 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 179.197 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -76.36 -60.82 2.17 Favored 'General case' 0 C--N 1.347 0.463 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 177.288 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 179.99 131.0 0.1 Allowed 'General case' 0 C--N 1.347 0.461 0 CA-C-O 120.686 0.279 . . . . 0.0 111.295 179.641 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 37.8 t 52.18 -94.52 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 C-N-CA 123.788 0.835 . . . . 0.0 111.497 176.31 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 66.9 m -149.96 -178.31 6.41 Favored 'General case' 0 C--N 1.344 0.364 0 CA-C-O 120.777 0.322 . . . . 0.0 110.368 -177.479 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 10.0 m -53.2 -35.26 59.68 Favored 'General case' 0 C--O 1.224 -0.259 0 C-N-CA 123.161 0.585 . . . . 0.0 110.975 -178.803 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 17.1 p -51.71 -46.86 64.1 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 122.46 0.304 . . . . 0.0 110.425 -179.29 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 24.9 m -65.62 -48.42 72.3 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 110.327 -0.249 . . . . 0.0 110.327 -178.907 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 87.5 t -60.38 -35.1 60.46 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.35 0 N-CA-C 110.242 -0.281 . . . . 0.0 110.242 -179.439 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 7.7 t -59.48 -45.06 92.72 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 109.983 -0.377 . . . . 0.0 109.983 -179.609 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 80.6 m-70 -58.49 -40.11 81.87 Favored 'General case' 0 N--CA 1.456 -0.135 0 O-C-N 122.996 0.185 . . . . 0.0 110.695 -179.021 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 52.9 t -56.27 -52.7 48.44 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.153 0 N-CA-C 110.003 -0.369 . . . . 0.0 110.003 -179.599 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 78.4 mt -66.04 -42.5 91.7 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 -179.415 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 37.8 t-20 -66.02 -20.92 66.34 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 122.973 0.509 . . . . 0.0 110.608 -179.545 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 74.3 tttt 66.24 50.98 1.29 Allowed 'General case' 0 C--N 1.343 0.289 0 C-N-CA 122.952 0.501 . . . . 0.0 109.655 -179.607 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -97.95 -82.89 0.41 Allowed 'General case' 0 C--N 1.341 0.212 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 179.665 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 19.0 ptp180 -87.36 154.17 20.89 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 179.792 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 50.5 t80 -123.83 145.39 49.11 Favored 'General case' 0 N--CA 1.456 -0.151 0 N-CA-C 109.886 -0.413 . . . . 0.0 109.886 -179.729 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.481 HG12 ' H ' ' A' ' 29' ' ' ALA . 2.9 t -134.97 172.87 15.35 Favored 'Isoleucine or valine' 0 C--O 1.231 0.114 0 N-CA-C 107.828 -1.175 . . . . 0.0 107.828 179.198 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.481 ' H ' HG12 ' A' ' 28' ' ' VAL . . . -48.08 149.52 1.41 Allowed 'General case' 0 C--O 1.235 0.331 0 N-CA-C 110.142 -0.318 . . . . 0.0 110.142 179.051 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 22.2 mp0 -51.3 -28.37 11.89 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.681 -179.225 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -57.02 -47.91 79.74 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 122.216 0.206 . . . . 0.0 110.499 179.624 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 10.4 m -64.82 -49.7 69.58 Favored 'General case' 0 C--N 1.344 0.359 0 N-CA-C 110.189 -0.3 . . . . 0.0 110.189 -178.74 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 38.4 mmt-85 -55.84 -50.64 70.0 Favored 'General case' 0 N--CA 1.455 -0.206 0 N-CA-C 109.785 -0.45 . . . . 0.0 109.785 -179.557 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -59.0 -48.49 81.38 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 122.552 0.341 . . . . 0.0 110.379 -179.613 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -57.83 -45.2 86.53 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 122.121 0.168 . . . . 0.0 110.678 -178.934 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 54.6 t -60.28 -57.24 12.73 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 N-CA-C 110.243 -0.28 . . . . 0.0 110.243 -178.985 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 41.4 m95 -60.63 -40.26 91.25 Favored 'General case' 0 CA--C 1.53 0.183 0 N-CA-C 110.735 -0.098 . . . . 0.0 110.735 -178.434 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -60.29 -53.14 61.24 Favored 'General case' 0 N--CA 1.453 -0.278 0 N-CA-C 109.722 -0.473 . . . . 0.0 109.722 179.69 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -56.41 -45.19 80.79 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 122.316 0.246 . . . . 0.0 110.493 -179.632 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 31.1 mt -56.18 -36.9 47.34 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.472 0 C-N-CA 122.256 0.223 . . . . 0.0 110.694 -179.314 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 6.3 mptp? -80.23 -45.6 17.71 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 -178.587 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 24.1 mm-40 -58.29 -47.4 83.78 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 122.48 0.312 . . . . 0.0 110.964 -178.052 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 6.0 mp -80.67 -1.8 44.01 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-O 119.611 -0.233 . . . . 0.0 110.777 -178.691 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 4.7 m-70 60.05 32.0 20.84 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 122.873 0.469 . . . . 0.0 110.905 178.454 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 10.2 t80 . . . . . 0 C--N 1.33 -0.243 0 N-CA-C 109.438 -0.579 . . . . 0.0 109.438 179.237 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 19.8 tt . . . . . 0 C--O 1.225 -0.204 0 N-CA-C 110.149 -0.315 . . . . 0.0 110.149 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 45.0 mtpt -57.01 -60.14 4.03 Favored 'General case' 0 N--CA 1.446 -0.625 0 C-N-CA 122.699 0.399 . . . . 0.0 110.475 179.059 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -70.19 -42.64 72.12 Favored 'General case' 0 N--CA 1.458 -0.068 0 N-CA-C 110.168 -0.308 . . . . 0.0 110.168 -177.683 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 54.8 t -55.01 -47.74 76.58 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.166 0 N-CA-C 110.188 -0.301 . . . . 0.0 110.188 -179.408 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -58.16 -54.98 40.86 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 122.349 0.26 . . . . 0.0 110.864 -178.455 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 27.0 tttt -65.79 -27.39 68.24 Favored 'General case' 0 CA--C 1.531 0.247 0 O-C-N 122.808 0.068 . . . . 0.0 110.908 -177.931 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.95 -36.22 69.82 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 177.759 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -78.19 -41.59 34.1 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.264 -178.427 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -155.12 -147.67 0.21 Allowed 'General case' 0 N--CA 1.449 -0.504 0 CA-C-O 120.841 0.353 . . . . 0.0 110.727 -177.321 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 62.0 t -71.44 -54.39 17.43 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.501 0 C-N-CA 123.012 0.525 . . . . 0.0 110.336 -178.804 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 50.8 m -155.49 -179.05 7.73 Favored 'General case' 0 C--N 1.346 0.42 0 CA-C-O 121.007 0.432 . . . . 0.0 110.806 -177.806 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.8 m -66.98 -3.26 6.67 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.158 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 16.6 p -57.83 -56.09 26.48 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 179.132 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -60.29 -33.86 72.95 Favored 'General case' 0 CA--C 1.537 0.442 0 N-CA-C 110.265 -0.272 . . . . 0.0 110.265 -179.268 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 58.1 t -64.51 -46.74 91.82 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.222 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 179.269 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 20.6 m -60.26 -43.28 96.28 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 178.753 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 48.5 m170 -58.19 -43.3 87.48 Favored 'General case' 0 C--O 1.221 -0.414 0 N-CA-C 109.867 -0.419 . . . . 0.0 109.867 179.357 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 7.3 t -68.2 -39.61 81.46 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 C-N-CA 122.351 0.26 . . . . 0.0 111.155 -179.045 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 40.3 mt -60.04 -59.14 4.48 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.395 0 CA-C-O 119.424 -0.322 . . . . 0.0 111.789 -176.521 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 11.2 p30 -114.14 22.12 14.13 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-N 118.235 0.47 . . . . 0.0 112.1 -175.644 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 29.6 ttpt 55.22 46.04 24.58 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 122.313 0.245 . . . . 0.0 110.774 177.96 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -66.93 -35.33 79.75 Favored 'General case' 0 C--N 1.341 0.203 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 179.088 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 9.7 tpt180 -142.08 143.08 32.9 Favored 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 -179.89 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 63.8 t80 -68.03 137.11 54.8 Favored 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 -179.903 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 10.5 m -141.49 153.76 19.81 Favored 'Isoleucine or valine' 0 C--O 1.236 0.375 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 178.592 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -66.11 159.43 26.18 Favored 'General case' 0 N--CA 1.45 -0.438 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 179.273 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -52.18 -41.82 62.96 Favored 'General case' 0 CA--C 1.529 0.135 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 179.641 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 51.2 mt-10 -52.19 -47.37 65.59 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 123.039 0.536 . . . . 0.0 111.075 -179.165 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -61.05 -46.96 88.57 Favored 'General case' 0 C--N 1.341 0.208 0 N-CA-C 110.104 -0.332 . . . . 0.0 110.104 -178.704 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 27.6 ttm105 -58.43 -53.68 55.62 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.338 -178.875 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 29.2 m120 -60.68 -46.1 91.62 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 116.676 -0.238 . . . . 0.0 110.54 -179.275 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -56.63 -47.92 78.66 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 122.428 0.291 . . . . 0.0 110.782 -178.555 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 24.5 t -58.92 -56.64 15.55 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.196 0 N-CA-C 110.319 -0.252 . . . . 0.0 110.319 -179.108 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 20.6 m95 -59.91 -36.39 76.89 Favored 'General case' 0 C--N 1.341 0.201 0 O-C-N 122.568 -0.083 . . . . 0.0 110.888 -178.537 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -65.42 -51.65 58.8 Favored 'General case' 0 N--CA 1.456 -0.172 0 N-CA-C 110.051 -0.352 . . . . 0.0 110.051 179.894 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -57.51 -43.13 83.97 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 122.615 0.366 . . . . 0.0 110.776 -179.026 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 33.0 mt -56.85 -42.67 78.53 Favored 'Isoleucine or valine' 0 C--N 1.34 0.196 0 C-N-CA 122.205 0.202 . . . . 0.0 110.496 -179.447 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 37.0 mtmm -76.82 -36.49 56.87 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 110.024 -0.361 . . . . 0.0 110.024 -179.168 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -60.89 -60.95 2.98 Favored 'General case' 0 N--CA 1.451 -0.402 0 O-C-N 123.259 0.35 . . . . 0.0 110.924 -178.27 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -81.09 -18.69 45.68 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-O 119.624 -0.227 . . . . 0.0 111.268 -177.5 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 5.1 m-70 76.18 128.48 0.04 OUTLIER 'General case' 0 C--N 1.344 0.346 0 C-N-CA 123.411 0.685 . . . . 0.0 109.701 -178.567 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 6.7 t80 . . . . . 0 C--O 1.218 -0.592 0 N-CA-C 108.404 -0.961 . . . . 0.0 108.404 178.168 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.47 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 11.4 tt . . . . . 0 N--CA 1.472 0.668 0 N-CA-C 108.26 -1.015 . . . . 0.0 108.26 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 67.0 mttm -61.11 -62.71 1.65 Allowed 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 123.428 0.691 . . . . 0.0 110.956 -178.114 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -51.94 -48.45 64.27 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.315 -178.98 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 10.9 t -65.01 -38.63 83.29 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.363 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.73 -177.705 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.25 -38.76 90.5 Favored 'General case' 0 CA--C 1.531 0.213 0 N-CA-C 110.414 -0.217 . . . . 0.0 110.414 -179.627 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 64.8 mmtt -73.47 -35.52 65.72 Favored 'General case' 0 CA--C 1.53 0.19 0 N-CA-C 110.121 -0.326 . . . . 0.0 110.121 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.59 -40.41 80.48 Favored 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 178.145 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -70.54 -48.55 54.9 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 123.024 0.53 . . . . 0.0 111.096 -178.585 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 4.6 t-20 -156.28 -137.16 0.06 Allowed 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 110.494 -0.187 . . . . 0.0 110.494 -178.017 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 87.4 t -92.5 -43.01 13.68 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.141 0 C-N-CA 122.873 0.469 . . . . 0.0 110.38 -177.668 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 27.0 t -152.46 167.44 28.75 Favored 'General case' 0 N--CA 1.453 -0.325 0 N-CA-C 110.068 -0.345 . . . . 0.0 110.068 -178.83 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 14.8 t -60.84 -27.75 68.31 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.201 -179.877 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 6.3 m -53.3 -54.14 40.71 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 122.555 0.342 . . . . 0.0 110.223 179.936 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 7.2 m -61.21 -45.45 94.51 Favored 'General case' 0 C--N 1.34 0.177 0 N-CA-C 110.25 -0.278 . . . . 0.0 110.25 -179.321 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 93.4 t -59.4 -38.1 73.18 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.231 0 N-CA-C 109.884 -0.413 . . . . 0.0 109.884 -179.7 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 21.0 t -65.87 -48.31 72.0 Favored 'General case' 0 N--CA 1.449 -0.495 0 N-CA-C 109.314 -0.625 . . . . 0.0 109.314 -179.611 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 59.4 m-70 -52.84 -47.27 67.84 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 110.572 -0.158 . . . . 0.0 110.572 -179.439 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 47.2 t -53.18 -49.95 48.82 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 N-CA-C 109.797 -0.446 . . . . 0.0 109.797 179.767 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 58.1 mt -64.63 -39.07 84.36 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 N-CA-C 110.1 -0.333 . . . . 0.0 110.1 -179.62 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 13.2 m120 -77.51 -4.99 48.44 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 122.22 0.208 . . . . 0.0 110.869 -179.476 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 93.4 mttt 57.33 49.95 12.32 Favored 'General case' 0 C--N 1.344 0.365 0 C-N-CA 122.917 0.487 . . . . 0.0 110.071 -179.701 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 1.1 p -109.63 -79.98 0.58 Allowed 'General case' 0 C--N 1.343 0.285 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 179.752 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 51.2 ttm-85 -72.1 96.6 1.79 Allowed 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 109.168 -0.678 . . . . 0.0 109.168 179.843 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 32.7 t80 -74.91 98.32 3.53 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 109.866 -0.42 . . . . 0.0 109.866 -179.157 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -85.15 177.55 0.59 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.373 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 178.712 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.5 159.38 29.78 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 178.326 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -57.25 -35.37 69.64 Favored 'General case' 0 N--CA 1.455 -0.214 0 N-CA-C 109.935 -0.394 . . . . 0.0 109.935 179.676 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 51.6 mt-10 -58.89 -51.57 69.46 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 122.355 0.262 . . . . 0.0 110.324 179.876 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.56 -43.02 81.66 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 110.067 -0.346 . . . . 0.0 110.067 -178.748 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 29.7 ttm105 -56.42 -51.25 69.07 Favored 'General case' 0 N--CA 1.454 -0.271 0 N-CA-C 110.055 -0.35 . . . . 0.0 110.055 179.902 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 88.7 m-20 -63.11 -45.3 92.66 Favored 'General case' 0 N--CA 1.456 -0.161 0 N-CA-C 110.09 -0.337 . . . . 0.0 110.09 -179.88 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -56.88 -41.87 78.81 Favored 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 110.509 -0.182 . . . . 0.0 110.509 -179.612 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 36.8 t -64.07 -54.58 29.71 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 N-CA-C 109.947 -0.39 . . . . 0.0 109.947 -179.676 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 29.6 m95 -56.91 -39.89 75.26 Favored 'General case' 0 C--N 1.34 0.19 0 N-CA-C 110.466 -0.198 . . . . 0.0 110.466 -179.316 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -65.03 -56.71 11.52 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 179.622 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -50.09 -45.15 52.41 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 123.062 0.545 . . . . 0.0 111.33 -179.001 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 26.0 mt -53.29 -44.2 53.01 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.233 0 C-N-CA 122.297 0.239 . . . . 0.0 110.703 -178.882 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 39.1 ttpt -81.05 -37.35 29.19 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 122.068 0.147 . . . . 0.0 110.61 -177.557 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 70.0 mt-10 -52.19 -58.33 6.93 Favored 'General case' 0 C--N 1.342 0.259 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 -179.083 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -75.92 -46.67 28.77 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 -179.665 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 69.43 130.98 0.03 OUTLIER 'General case' 0 C--N 1.347 0.48 0 C-N-CA 123.22 0.608 . . . . 0.0 109.718 -178.988 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.47 ' CE2' ' HA ' ' A' ' 4' ' ' ILE . 5.1 p90 . . . . . 0 CA--C 1.537 0.446 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 179.398 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.473 0.704 0 N-CA-C 110.253 -0.277 . . . . 0.0 110.253 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -70.78 -59.36 2.85 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 123.075 0.55 . . . . 0.0 110.39 -178.552 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -45.37 -58.56 3.23 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.721 0.808 . . . . 0.0 111.314 -178.422 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 88.3 t -61.44 -47.1 94.99 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.151 0 C-N-CA 122.57 0.348 . . . . 0.0 110.794 -177.15 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -56.74 -44.47 81.73 Favored 'General case' 0 N--CA 1.455 -0.205 0 O-C-N 122.24 -0.288 . . . . 0.0 110.299 -179.548 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.429 ' C ' ' H ' ' A' ' 12' ' ' ASN . 53.0 mttp -72.4 -15.61 61.84 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-O 119.187 -0.435 . . . . 0.0 111.441 -177.887 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 8.6 tpm_? -59.3 -43.87 92.57 Favored 'General case' 0 C--N 1.343 0.297 0 N-CA-C 108.034 -1.098 . . . . 0.0 108.034 177.091 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -99.15 7.08 46.15 Favored 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 176.298 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' ASN . . . . . 0.429 ' H ' ' C ' ' A' ' 9' ' ' LYS . 47.5 t30 70.74 -84.9 0.03 OUTLIER 'General case' 0 C--N 1.347 0.497 0 C-N-CA 124.519 1.127 . . . . 0.0 110.163 -179.442 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 2.7 t 29.44 -125.2 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.74 0 C-N-CA 124.518 1.127 . . . . 0.0 110.564 -177.845 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.413 ' C ' ' H ' ' A' ' 16' ' ' THR . 1.5 m -175.25 84.52 0.03 OUTLIER 'General case' 0 C--N 1.347 0.487 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 179.084 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.4 p 50.7 -2.5 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 125.252 1.421 . . . . 0.0 114.697 177.591 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.413 ' H ' ' C ' ' A' ' 14' ' ' SER . 0.8 OUTLIER -88.68 -42.47 11.96 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 118.54 0.609 . . . . 0.0 110.669 -177.947 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 13.2 t -51.41 -42.25 61.33 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 122.334 0.253 . . . . 0.0 111.361 -177.908 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 42.4 t -60.12 -54.82 29.5 Favored 'Isoleucine or valine' 0 C--O 1.232 0.134 0 N-CA-C 109.93 -0.396 . . . . 0.0 109.93 -179.076 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 19.7 m -60.0 -42.02 93.38 Favored 'General case' 0 C--O 1.222 -0.361 0 CA-C-N 116.67 -0.241 . . . . 0.0 110.613 -179.496 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 24.3 m170 -62.58 -43.92 97.61 Favored 'General case' 0 CA--C 1.528 0.123 0 C-N-CA 122.202 0.201 . . . . 0.0 110.579 -178.455 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 9.3 t -64.56 -49.61 79.74 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.187 0 C-N-CA 122.249 0.22 . . . . 0.0 110.613 -178.616 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 89.1 mt -65.9 -51.5 60.38 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.23 0 N-CA-C 110.044 -0.354 . . . . 0.0 110.044 -178.669 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 20.4 t-20 -63.88 -31.47 72.67 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 122.649 0.38 . . . . 0.0 111.016 -178.693 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 17.7 ttmt 67.13 40.34 2.88 Favored 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 -177.822 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 12.5 t -74.68 -29.48 61.24 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.331 -179.015 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 2.0 tmt_? -157.96 125.02 5.01 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 -179.423 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 46.4 p90 -59.08 147.87 33.24 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 110.026 -0.361 . . . . 0.0 110.026 -179.878 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -106.66 -173.05 0.42 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.327 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 -179.877 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -79.18 40.93 0.43 Allowed 'General case' 0 CA--C 1.536 0.44 0 O-C-N 122.353 -0.217 . . . . 0.0 111.493 -178.06 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 63.95 -74.58 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 123.347 0.659 . . . . 0.0 111.607 178.238 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -58.88 -35.06 72.38 Favored 'General case' 0 C--N 1.341 0.207 0 C-N-CA 122.5 0.32 . . . . 0.0 110.776 -177.946 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 8.9 m -61.06 -40.65 94.47 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 179.205 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 19.5 ttt180 -71.03 -43.03 68.7 Favored 'General case' 0 N--CA 1.454 -0.235 0 N-CA-C 109.689 -0.486 . . . . 0.0 109.689 179.383 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 35.0 t30 -58.07 -45.02 87.81 Favored 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 109.857 -0.423 . . . . 0.0 109.857 179.217 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -58.26 -42.58 86.77 Favored 'General case' 0 N--CA 1.456 -0.174 0 C-N-CA 122.541 0.337 . . . . 0.0 110.667 -179.505 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 25.6 t -62.67 -53.52 45.95 Favored 'Isoleucine or valine' 0 C--O 1.233 0.225 0 N-CA-C 109.924 -0.398 . . . . 0.0 109.924 -179.737 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 38.8 m95 -59.11 -39.97 83.94 Favored 'General case' 0 C--N 1.339 0.144 0 N-CA-C 110.487 -0.19 . . . . 0.0 110.487 -179.828 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -63.76 -52.32 60.94 Favored 'General case' 0 C--O 1.222 -0.369 0 N-CA-C 110.175 -0.306 . . . . 0.0 110.175 -179.459 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -56.07 -39.77 72.57 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 122.386 0.274 . . . . 0.0 111.334 -178.378 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 19.8 mt -53.34 -56.56 7.75 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 C-N-CA 122.219 0.208 . . . . 0.0 111.399 -177.617 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.3 -26.56 24.86 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 117.688 0.222 . . . . 0.0 111.473 -176.536 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -71.23 -47.71 55.65 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 117.875 0.307 . . . . 0.0 110.544 -178.195 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 79.1 mt -80.08 -14.59 58.4 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-O 119.389 -0.339 . . . . 0.0 110.939 -178.38 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 88.0 m-70 53.35 45.5 28.29 Favored 'General case' 0 C--N 1.348 0.514 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 -178.989 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.547 0.827 0 CA-C-N 115.76 -0.655 . . . . 0.0 112.673 -177.295 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 19.6 tt . . . . . 0 C--O 1.221 -0.444 0 N-CA-C 109.937 -0.394 . . . . 0.0 109.937 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -60.24 -64.15 1.05 Allowed 'General case' 0 N--CA 1.441 -0.91 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.295 -177.887 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -61.27 -52.82 63.15 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 122.963 0.505 . . . . 0.0 111.368 -178.177 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 86.2 t -59.36 -42.59 87.91 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.291 0 CA-C-O 119.517 -0.278 . . . . 0.0 111.272 -176.583 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -54.93 -53.71 52.05 Favored 'General case' 0 C--N 1.341 0.23 0 CA-C-N 118.014 0.37 . . . . 0.0 110.151 -179.128 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 20.1 mmmt -60.68 -47.92 84.12 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 110.006 -0.368 . . . . 0.0 110.006 -178.509 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.49 -37.16 77.52 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 116.455 -0.338 . . . . 0.0 110.624 -178.903 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -73.58 -47.84 37.45 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 122.089 0.156 . . . . 0.0 110.649 -178.489 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 50.1 t30 -171.25 139.78 1.38 Allowed 'General case' 0 C--N 1.347 0.485 0 N-CA-C 110.204 -0.295 . . . . 0.0 110.204 -177.562 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER 23.32 -87.3 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.954 0 C-N-CA 125.162 1.385 . . . . 0.0 112.811 177.636 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 71.8 m -151.18 -172.07 4.11 Favored 'General case' 0 C--N 1.348 0.518 0 C-N-CA 122.647 0.379 . . . . 0.0 110.074 -179.32 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 21.3 p -55.31 -16.19 3.19 Favored 'General case' 0 C--N 1.345 0.401 0 C-N-CA 123.253 0.621 . . . . 0.0 111.518 -179.053 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 4.7 m -52.41 -39.97 61.58 Favored 'General case' 0 CA--C 1.534 0.362 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 177.118 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 75.4 m -69.68 -40.17 76.54 Favored 'General case' 0 C--N 1.342 0.261 0 N-CA-C 109.95 -0.389 . . . . 0.0 109.95 179.054 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 84.0 t -59.46 -37.85 72.03 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.21 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 179.858 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 15.7 m -56.06 -39.12 71.55 Favored 'General case' 0 C--N 1.341 0.196 0 N-CA-C 110.067 -0.346 . . . . 0.0 110.067 179.146 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 23.8 m170 -62.57 -29.71 70.79 Favored 'General case' 0 C--O 1.223 -0.307 0 N-CA-C 110.155 -0.313 . . . . 0.0 110.155 179.991 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.594 HG22 ' HD2' ' A' ' 33' ' ' ARG . 5.1 t -80.42 -49.37 18.82 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.141 0 C-N-CA 122.202 0.201 . . . . 0.0 110.912 -177.97 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 78.9 mt -44.81 -53.99 1.35 Allowed 'Isoleucine or valine' 0 C--N 1.341 0.238 0 C-N-CA 122.811 0.444 . . . . 0.0 111.455 -175.675 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 10.4 p30 -114.43 26.74 10.0 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-O 119.861 -0.114 . . . . 0.0 110.923 -177.852 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 74.1 tttt 40.61 51.68 3.01 Favored 'General case' 0 C--N 1.346 0.437 0 C-N-CA 123.009 0.524 . . . . 0.0 110.68 179.62 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -67.12 -31.81 72.52 Favored 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 -179.811 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 59.2 ttt85 -158.1 111.86 2.49 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 179.658 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 48.8 p90 -78.53 136.71 37.63 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 109.205 -0.665 . . . . 0.0 109.205 179.425 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 57.3 t -112.44 83.74 0.69 Allowed 'Isoleucine or valine' 0 N--CA 1.457 -0.121 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 179.703 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 59.44 13.4 3.21 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 115.683 -0.689 . . . . 0.0 111.535 -179.335 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 71.17 -55.93 0.64 Allowed 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 123.912 0.885 . . . . 0.0 111.538 179.431 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -45.14 -46.92 12.22 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.355 0.662 . . . . 0.0 111.853 -177.805 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 32.1 m -58.86 -39.88 82.66 Favored 'General case' 0 N--CA 1.455 -0.207 0 O-C-N 122.226 -0.296 . . . . 0.0 110.266 -178.512 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' ARG . . . . . 0.594 ' HD2' HG22 ' A' ' 21' ' ' VAL . 20.2 mmt180 -70.42 -40.47 73.8 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 -178.977 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 13.4 m-80 -61.9 -39.73 93.02 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 178.208 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -61.21 -52.17 65.9 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 109.959 -0.386 . . . . 0.0 109.959 179.468 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 53.4 t -55.17 -50.69 62.01 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 N-CA-C 110.116 -0.327 . . . . 0.0 110.116 178.844 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 10.5 m95 -58.59 -40.71 83.99 Favored 'General case' 0 C--N 1.341 0.224 0 N-CA-C 110.368 -0.234 . . . . 0.0 110.368 -179.73 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -62.61 -49.77 73.89 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 179.473 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -56.07 -41.87 75.79 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 122.42 0.288 . . . . 0.0 110.421 179.936 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.406 ' HA ' ' CE1' ' A' ' 45' ' ' TYR . 37.3 mt -61.71 -34.47 62.37 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 N-CA-C 110.461 -0.2 . . . . 0.0 110.461 -179.805 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 4.1 ttpm? -83.0 -36.58 24.91 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 122.362 0.265 . . . . 0.0 110.708 -177.3 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -77.54 -47.79 18.63 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 122.191 0.196 . . . . 0.0 111.502 -177.076 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 79.0 mt -76.98 -29.6 55.6 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-O 119.74 -0.172 . . . . 0.0 110.842 -177.897 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 6.3 m-70 73.78 121.98 0.04 OUTLIER 'General case' 0 C--N 1.344 0.362 0 C-N-CA 123.27 0.628 . . . . 0.0 109.632 -178.612 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.406 ' CE1' ' HA ' ' A' ' 40' ' ' ILE . 3.4 m-85 . . . . . 0 N--CA 1.463 0.185 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 -179.724 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 7.1 mt . . . . . 0 C--O 1.219 -0.54 0 CA-C-O 119.677 -0.202 . . . . 0.0 110.819 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 20.8 ttpp -49.67 -55.75 12.65 Favored 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 111.879 0.325 . . . . 0.0 111.879 -176.754 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 -79.86 -42.28 24.58 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 118.247 0.476 . . . . 0.0 110.553 -176.652 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 28.6 t -57.33 -35.03 47.62 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.36 0 C-N-CA 122.442 0.297 . . . . 0.0 110.586 -180.0 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -52.93 -66.09 0.44 Allowed 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 123.224 0.609 . . . . 0.0 111.042 -178.59 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.95 -35.79 72.33 Favored 'General case' 0 C--N 1.334 -0.107 0 CA-C-O 119.592 -0.242 . . . . 0.0 110.435 -178.971 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 12.5 tpt180 -55.26 -40.35 70.86 Favored 'General case' 0 C--N 1.341 0.206 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 178.743 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -68.78 -62.75 1.25 Allowed 'General case' 0 N--CA 1.448 -0.558 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 177.615 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -177.58 -88.24 0.0 OUTLIER 'General case' 0 C--N 1.351 0.667 0 N-CA-C 112.066 0.395 . . . . 0.0 112.066 178.585 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 55.7 t -69.23 -86.38 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.343 0.291 0 C-N-CA 122.476 0.31 . . . . 0.0 111.205 -174.473 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 9.0 t -158.48 -157.94 0.67 Allowed 'General case' 0 N--CA 1.45 -0.437 0 N-CA-C 110.173 -0.306 . . . . 0.0 110.173 -177.421 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 38.0 p -55.82 -30.17 60.95 Favored 'General case' 0 C--N 1.341 0.221 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.188 -179.532 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 16.6 p -49.94 -44.51 50.5 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 122.756 0.422 . . . . 0.0 110.219 179.127 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 21.3 m -53.24 -36.26 60.88 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 122.43 0.292 . . . . 0.0 110.477 -179.686 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 25.8 t -80.86 -44.26 21.18 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.294 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 179.627 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 14.8 m -55.21 -32.23 62.08 Favored 'General case' 0 C--N 1.344 0.357 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 -179.427 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 62.4 m170 -54.83 -64.72 0.74 Allowed 'General case' 0 N--CA 1.445 -0.696 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.157 179.356 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 15.7 t -62.36 -27.82 43.43 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.246 0 C-N-CA 120.997 -0.281 . . . . 0.0 111.396 -176.495 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 6.1 mm -65.69 -51.68 59.47 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.518 0 CA-C-N 117.872 0.306 . . . . 0.0 110.826 -178.818 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 8.9 p-10 -167.6 31.53 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 117.937 0.335 . . . . 0.0 111.556 -177.595 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 26.6 tptt -158.74 40.11 0.23 Allowed 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 120.69 -0.404 . . . . 0.0 110.624 -179.59 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 10.0 t -79.68 -31.02 41.3 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.664 -176.228 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 56.8 mtm180 57.36 -158.94 0.26 Allowed 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 109.549 -0.537 . . . . 0.0 109.549 179.962 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -80.4 99.17 7.83 Favored 'General case' 0 N--CA 1.453 -0.278 0 O-C-N 122.151 -0.343 . . . . 0.0 110.717 -178.006 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.0 m -143.69 161.55 16.26 Favored 'Isoleucine or valine' 0 C--O 1.233 0.221 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 175.955 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -74.0 170.17 15.98 Favored 'General case' 0 N--CA 1.446 -0.625 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 179.559 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 47.6 mm-40 -64.65 -18.01 64.56 Favored 'General case' 0 C--O 1.223 -0.306 0 N-CA-C 110.178 -0.304 . . . . 0.0 110.178 178.64 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -48.74 -55.14 12.3 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 122.943 0.497 . . . . 0.0 110.92 179.922 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 4.6 p -65.36 -41.22 94.07 Favored 'General case' 0 CA--C 1.531 0.243 0 O-C-N 122.378 -0.201 . . . . 0.0 111.045 -178.153 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 74.6 mtt85 -63.76 -53.66 47.56 Favored 'General case' 0 C--O 1.232 0.175 0 N-CA-C 111.375 0.139 . . . . 0.0 111.375 -177.205 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -69.36 -36.33 76.75 Favored 'General case' 0 C--O 1.223 -0.305 0 CA-C-O 119.677 -0.201 . . . . 0.0 110.732 -176.602 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -58.48 -50.69 72.83 Favored 'General case' 0 C--N 1.342 0.244 0 CA-C-N 117.843 0.292 . . . . 0.0 110.68 -178.99 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 48.7 t -58.06 -58.36 6.71 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.277 0 N-CA-C 110.559 -0.163 . . . . 0.0 110.559 -178.639 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 15.0 m95 -59.3 -40.26 85.65 Favored 'General case' 0 C--N 1.341 0.213 0 N-CA-C 110.747 -0.094 . . . . 0.0 110.747 -178.244 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -59.88 -50.8 72.35 Favored 'General case' 0 C--O 1.22 -0.455 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 -179.458 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -60.25 -47.74 84.71 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 122.026 0.131 . . . . 0.0 110.694 -179.199 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 58.5 mt -55.76 -47.41 79.41 Favored 'Isoleucine or valine' 0 C--N 1.341 0.2 0 C-N-CA 122.324 0.25 . . . . 0.0 111.105 -178.386 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -77.33 -41.14 41.67 Favored 'General case' 0 N--CA 1.448 -0.545 0 N-CA-C 110.372 -0.233 . . . . 0.0 110.372 -176.235 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -57.09 -48.46 78.56 Favored 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 110.161 -0.311 . . . . 0.0 110.161 -178.489 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 55.4 mt -83.7 -20.7 33.01 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.022 -178.458 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 91.4 m-70 55.89 26.53 9.85 Favored 'General case' 0 C--N 1.351 0.632 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 -176.956 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 16.6 t80 . . . . . 0 CA--C 1.535 0.374 0 C-N-CA 123.319 0.648 . . . . 0.0 109.772 -175.541 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.467 0.404 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 26.2 mmtp -46.53 -62.07 1.53 Allowed 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 122.837 0.455 . . . . 0.0 111.187 179.043 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 30.1 m-20 -91.17 -32.46 15.8 Favored 'General case' 0 C--N 1.347 0.468 0 CA-C-N 117.909 0.322 . . . . 0.0 111.425 -176.337 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 70.4 t -58.12 -42.97 84.46 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 179.222 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.94 -42.64 97.27 Favored 'General case' 0 C--O 1.22 -0.451 0 N-CA-C 110.372 -0.233 . . . . 0.0 110.372 179.823 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 41.3 mtpt -61.34 -47.51 85.57 Favored 'General case' 0 C--N 1.338 0.108 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 179.627 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -55.19 -39.89 70.09 Favored 'General case' 0 N--CA 1.454 -0.233 0 N-CA-C 109.492 -0.559 . . . . 0.0 109.492 179.602 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -70.31 -56.55 6.45 Favored 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 110.368 -0.234 . . . . 0.0 110.368 179.847 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 45.2 t30 -170.91 126.34 0.7 Allowed 'General case' 0 C--N 1.347 0.487 0 CA-C-N 117.387 0.085 . . . . 0.0 111.194 -177.743 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 51.3 t 51.68 -91.31 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.539 0 C-N-CA 123.895 0.878 . . . . 0.0 111.809 176.419 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 28.3 m -157.44 -169.93 3.06 Favored 'General case' 0 C--N 1.346 0.417 0 N-CA-C 109.785 -0.45 . . . . 0.0 109.785 -177.591 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 80.4 p -49.87 -26.7 4.3 Favored 'General case' 0 C--N 1.347 0.496 0 C-N-CA 123.212 0.605 . . . . 0.0 111.104 -179.771 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 18.6 p -50.25 -44.19 53.42 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 122.396 0.279 . . . . 0.0 110.289 179.063 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.3 t -59.88 -37.63 79.89 Favored 'General case' 0 CA--C 1.534 0.333 0 N-CA-C 110.563 -0.162 . . . . 0.0 110.563 -178.621 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 64.6 t -68.62 -45.6 81.29 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.246 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 179.821 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 20.2 m -57.16 -45.74 83.35 Favored 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 179.076 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 52.2 m170 -57.66 -46.32 84.38 Favored 'General case' 0 C--N 1.339 0.152 0 C-N-CA 122.353 0.261 . . . . 0.0 110.373 -179.743 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 32.9 t -65.41 -51.93 58.04 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.05 -178.101 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 94.9 mt -59.49 -54.1 39.14 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.217 0 N-CA-C 110.377 -0.231 . . . . 0.0 110.377 -177.912 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 43.5 m-80 -70.61 -18.98 62.88 Favored 'General case' 0 CA--C 1.532 0.288 0 N-CA-C 110.386 -0.227 . . . . 0.0 110.386 -179.007 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 74.2 tttt 61.05 46.14 8.56 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 122.878 0.471 . . . . 0.0 109.928 179.476 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 15.8 p -96.25 -80.18 0.43 Allowed 'General case' 0 C--N 1.341 0.199 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 179.632 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 78.7 ttt180 -78.81 100.76 7.29 Favored 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 108.968 -0.752 . . . . 0.0 108.968 179.15 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 90.8 t80 -62.11 144.13 55.73 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 109.967 -0.383 . . . . 0.0 109.967 -179.995 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 5.4 m -130.67 170.8 18.83 Favored 'Isoleucine or valine' 0 CA--C 1.523 -0.081 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 179.463 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -61.78 158.4 15.85 Favored 'General case' 0 N--CA 1.45 -0.449 0 N-CA-C 109.978 -0.379 . . . . 0.0 109.978 179.796 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 50.7 mm-40 -48.73 -45.01 38.9 Favored 'General case' 0 C--N 1.34 0.178 0 CA-C-N 116.042 -0.526 . . . . 0.0 109.889 179.049 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -52.85 -53.7 45.07 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 122.715 0.406 . . . . 0.0 111.436 -178.146 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 10.0 m -61.15 -51.94 66.96 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 117.804 0.274 . . . . 0.0 110.817 -177.179 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 30.9 ttp180 -58.53 -52.76 64.27 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 122.02 0.128 . . . . 0.0 110.798 -177.931 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 90.5 m-20 -63.34 -40.67 97.94 Favored 'General case' 0 N--CA 1.455 -0.189 0 N-CA-C 110.465 -0.198 . . . . 0.0 110.465 -178.025 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -61.14 -47.85 84.31 Favored 'General case' 0 C--O 1.224 -0.258 0 N-CA-C 110.284 -0.265 . . . . 0.0 110.284 -179.885 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 13.1 t -54.31 -52.41 39.08 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 179.926 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 26.0 m95 -62.85 -38.21 89.9 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 110.059 -0.348 . . . . 0.0 110.059 179.874 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -89.01 28.12 1.24 Allowed 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 122.251 0.22 . . . . 0.0 110.606 179.784 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -131.14 -46.63 1.01 Allowed 'General case' 0 N--CA 1.456 -0.14 0 N-CA-C 108.474 -0.936 . . . . 0.0 108.474 176.76 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 60.7 mt -55.48 -46.77 78.9 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.224 0 N-CA-C 109.839 -0.43 . . . . 0.0 109.839 178.902 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 4.6 ptpp? -107.81 32.93 4.36 Favored 'General case' 0 C--N 1.344 0.365 0 C-N-CA 122.144 0.178 . . . . 0.0 110.634 -178.609 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -138.77 -55.75 0.61 Allowed 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 179.181 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -85.18 13.67 6.06 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 110.048 -0.352 . . . . 0.0 110.048 179.309 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 3.8 t-80 78.39 149.95 0.11 Allowed 'General case' 0 N--CA 1.446 -0.632 0 CA-C-O 121.807 0.813 . . . . 0.0 110.88 177.644 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 26.2 t80 . . . . . 0 C--N 1.32 -0.692 0 CA-C-N 114.336 -1.302 . . . . 0.0 108.812 179.003 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 52.6 ttp . . . . . 0 N--CA 1.473 0.709 0 N-CA-C 109.754 -0.462 . . . . 0.0 109.754 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -157.01 163.88 38.6 Favored 'General case' 0 C--O 1.234 0.267 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 24.7 m -158.0 -64.74 0.09 Allowed 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 121.899 0.079 . . . . 0.0 110.911 -178.083 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.487 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 0.3 OUTLIER -152.03 -40.76 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.567 0 N-CA-C 109.94 -0.392 . . . . 0.0 109.94 -177.468 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 34.5 ttmt -55.55 -39.65 70.89 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 122.846 0.458 . . . . 0.0 111.081 -178.944 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -51.51 -64.93 0.65 Allowed 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 122.898 0.479 . . . . 0.0 111.414 -176.731 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 86.8 t -69.39 -31.81 50.87 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.371 0 N-CA-C 110.646 -0.131 . . . . 0.0 110.646 -177.211 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.04 -41.97 97.58 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 110.267 -0.272 . . . . 0.0 110.267 -179.888 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 31.4 mmtm -81.3 -31.58 33.53 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 122.439 0.296 . . . . 0.0 110.822 -179.168 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 1.3 tpm_? -75.64 -47.52 26.07 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 117.427 0.103 . . . . 0.0 111.047 -177.898 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -80.68 -49.03 11.74 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 122.163 0.185 . . . . 0.0 111.006 -177.073 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 22.4 m-80 -123.66 -145.41 0.34 Allowed 'General case' 0 C--N 1.341 0.23 0 N-CA-C 109.735 -0.469 . . . . 0.0 109.735 -177.967 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 58.6 t -102.22 -41.95 8.42 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.249 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 -179.902 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 8.3 t -155.16 176.85 12.02 Favored 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 109.925 -0.398 . . . . 0.0 109.925 -179.752 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 12.6 m -61.47 -21.47 64.2 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.617 -179.284 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 3.7 m -52.18 -49.16 64.38 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 110.179 -0.304 . . . . 0.0 110.179 179.379 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 7.1 m -65.43 -33.32 75.66 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 122.148 0.179 . . . . 0.0 110.722 -179.369 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 58.5 t -68.32 -45.58 82.31 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 -179.79 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 60.4 p -60.42 -35.72 76.47 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-O 119.731 -0.176 . . . . 0.0 110.739 -178.787 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 55.0 m170 -52.61 -37.54 58.45 Favored 'General case' 0 C--N 1.347 0.466 0 CA-C-O 120.568 0.223 . . . . 0.0 110.631 -179.882 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 60.1 t -72.35 -40.2 64.37 Favored 'Isoleucine or valine' 0 C--O 1.234 0.278 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.493 -178.88 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 76.2 mt -68.84 -56.18 13.04 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.194 0 C-N-CA 122.405 0.282 . . . . 0.0 110.514 -177.854 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 31.1 p30 -76.55 -10.92 59.74 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 119.701 -0.19 . . . . 0.0 111.216 -177.877 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 39.7 mtmt 56.45 38.7 29.91 Favored 'General case' 0 C--N 1.345 0.411 0 C-N-CA 122.674 0.389 . . . . 0.0 110.319 179.257 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 10.3 t -82.23 -34.18 28.97 Favored 'General case' 0 C--N 1.34 0.155 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 179.91 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 89.2 mtt-85 -134.18 69.97 1.46 Allowed 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 178.236 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 87.5 t80 -59.47 111.16 1.29 Allowed 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 116.097 -0.501 . . . . 0.0 109.78 -179.038 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.577 HG12 ' H ' ' A' ' 29' ' ' ALA . 12.0 t -76.13 173.68 0.93 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 179.31 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.577 ' H ' HG12 ' A' ' 28' ' ' VAL . . . -76.89 52.61 0.87 Allowed 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 122.337 0.255 . . . . 0.0 111.455 -178.056 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 69.08 -32.16 0.22 Allowed 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.025 0.93 . . . . 0.0 112.975 177.023 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 51.6 mt-10 -50.87 -61.93 1.91 Allowed 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 118.52 0.6 . . . . 0.0 110.836 -177.916 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 45.5 m -61.14 -41.19 96.29 Favored 'General case' 0 C--O 1.225 -0.204 0 CA-C-N 116.738 -0.21 . . . . 0.0 110.599 -178.482 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 12.1 ttm180 -56.04 -55.39 33.4 Favored 'General case' 0 CA--C 1.531 0.247 0 N-CA-C 110.286 -0.265 . . . . 0.0 110.286 -179.152 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 21.5 m120 -61.84 -46.05 91.14 Favored 'General case' 0 N--CA 1.455 -0.201 0 N-CA-C 110.282 -0.266 . . . . 0.0 110.282 -179.353 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -56.84 -43.07 80.74 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 122.194 0.198 . . . . 0.0 110.785 -179.12 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 16.4 t -63.43 -57.47 11.72 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.184 0 N-CA-C 110.339 -0.245 . . . . 0.0 110.339 -178.875 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 19.0 m95 -58.87 -37.79 77.35 Favored 'General case' 0 CA--C 1.53 0.197 0 N-CA-C 110.682 -0.118 . . . . 0.0 110.682 -178.466 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -66.02 -53.13 42.52 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 109.953 -0.388 . . . . 0.0 109.953 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.96 -41.62 87.93 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 122.54 0.336 . . . . 0.0 110.893 -178.611 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 19.7 mt -53.37 -46.14 57.67 Favored 'Isoleucine or valine' 0 C--N 1.34 0.194 0 C-N-CA 122.218 0.207 . . . . 0.0 110.547 -179.38 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 7.8 mtpm? -79.82 -37.35 35.28 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 110.303 -0.258 . . . . 0.0 110.303 -177.848 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -59.34 -57.28 13.68 Favored 'General case' 0 N--CA 1.451 -0.379 0 N-CA-C 110.109 -0.33 . . . . 0.0 110.109 -178.523 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -70.91 -43.21 68.76 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 -179.68 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 9.9 t60 65.03 118.72 0.02 OUTLIER 'General case' 0 C--N 1.349 0.567 0 C-N-CA 123.462 0.705 . . . . 0.0 110.091 -178.834 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.487 ' CE2' ' HA ' ' A' ' 4' ' ' ILE . 0.0 OUTLIER -156.46 50.32 0.5 Allowed 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.276 -179.4 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 10.4 t -50.99 119.25 11.61 Favored Pre-proline 0 CA--C 1.537 0.457 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.058 -179.171 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 4.5 Cg_endo -64.0 -26.3 66.27 Favored 'Trans proline' 0 N--CA 1.451 -1.019 0 C-N-CA 122.48 2.12 . . . . 0.0 110.885 -179.801 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 50.6 m -148.96 138.83 22.03 Favored 'General case' 0 N--CA 1.455 -0.202 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 179.395 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . 64.78 91.0 0.08 Allowed 'General case' 0 C--N 1.343 0.284 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 -178.63 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 8.0 p -65.65 -30.61 50.64 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.377 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.711 -179.149 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -60.33 -66.33 0.54 Allowed 'General case' 0 C--N 1.342 0.269 0 N-CA-C 110.369 -0.234 . . . . 0.0 110.369 -179.162 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 31.2 ttt180 -163.26 -143.8 0.08 Allowed 'General case' 0 N--CA 1.449 -0.497 0 N-CA-C 108.544 -0.91 . . . . 0.0 108.544 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 30.8 p -169.11 112.6 0.53 Allowed 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 -179.588 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -159.39 159.42 33.75 Favored 'General case' 0 N--CA 1.455 -0.187 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 179.795 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 12.3 tptp 57.2 -148.52 0.49 Allowed 'General case' 0 CA--C 1.538 0.519 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 19.2 m . . . . . 0 C--O 1.25 1.11 0 CA-C-O 117.01 -1.471 . . . . 0.0 108.92 179.905 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 20.8 ptm . . . . . 0 N--CA 1.475 0.801 0 N-CA-C 110.053 -0.351 . . . . 0.0 110.053 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 71.47 146.2 0.07 Allowed 'General case' 0 C--N 1.344 0.354 0 C-N-CA 123.315 0.646 . . . . 0.0 110.41 -179.809 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' THR . . . . . 0.551 ' O ' HG22 ' A' ' 7' ' ' VAL . 68.4 m -163.1 -51.78 0.04 OUTLIER 'General case' 0 C--N 1.342 0.257 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 -178.865 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 15.3 tt -47.64 -33.47 3.29 Favored 'Isoleucine or valine' 0 C--N 1.349 0.581 0 C-N-CA 123.326 0.651 . . . . 0.0 111.214 -179.468 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 3.6 mmmm -70.19 -58.96 3.19 Favored 'General case' 0 N--CA 1.447 -0.576 0 N-CA-C 110.175 -0.305 . . . . 0.0 110.175 -179.735 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -59.83 -56.75 17.89 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 123.403 0.44 . . . . 0.0 111.749 -176.948 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.551 HG22 ' O ' ' A' ' 3' ' ' THR . 17.1 m -43.55 -56.07 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 C-N-CA 122.83 0.452 . . . . 0.0 112.196 -174.039 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.508 ' H ' HG23 ' A' ' 7' ' ' VAL . . . -48.17 -50.24 29.7 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.769 -178.329 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 8.5 mptt -74.66 -34.32 62.69 Favored 'General case' 0 CA--C 1.534 0.347 0 O-C-N 122.436 -0.165 . . . . 0.0 110.736 -178.496 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 11.0 mmt-85 -58.78 -56.19 25.4 Favored 'General case' 0 C--N 1.341 0.205 0 N-CA-C 109.502 -0.555 . . . . 0.0 109.502 179.093 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -68.96 -8.23 42.64 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.688 179.498 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 60.9 63.11 1.33 Allowed 'General case' 0 C--N 1.343 0.291 0 C-N-CA 123.018 0.527 . . . . 0.0 110.254 178.963 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 2.1 m -137.2 -109.48 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.455 -0.191 0 N-CA-C 108.518 -0.919 . . . . 0.0 108.518 177.677 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 10.0 p -169.25 147.05 3.67 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 179.812 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 9.3 t -51.39 -33.06 28.38 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.534 179.552 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 20.2 p -49.83 -54.21 20.76 Favored 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 109.863 -0.421 . . . . 0.0 109.863 179.075 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 10.5 m -53.31 -46.05 69.23 Favored 'General case' 0 N--CA 1.456 -0.151 0 C-N-CA 122.63 0.372 . . . . 0.0 110.094 179.466 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 20.1 t -64.85 -27.08 41.62 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.18 0 CA-C-N 116.433 -0.348 . . . . 0.0 110.824 -178.577 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 45.2 m -77.42 -48.86 16.12 Favored 'General case' 0 CA--C 1.506 -0.732 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 179.844 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 18.2 m-70 -55.54 -39.82 71.08 Favored 'General case' 0 C--O 1.201 -1.47 0 O-C-N 123.329 0.393 . . . . 0.0 110.046 -179.626 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 19.6 t -52.16 -32.89 16.12 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.389 0 CA-C-N 118.192 0.451 . . . . 0.0 110.784 -179.367 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 32.1 mm -75.33 -34.96 31.89 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.415 0 N-CA-C 111.989 0.366 . . . . 0.0 111.989 -177.738 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.3 p-10 -100.56 -40.32 7.47 Favored 'General case' 0 N--CA 1.481 1.097 0 CA-C-N 118.398 0.545 . . . . 0.0 111.337 -176.486 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.821 ' O ' HG23 ' A' ' 25' ' ' THR . 36.2 ttpt -153.74 -89.89 0.05 OUTLIER 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 108.13 -1.063 . . . . 0.0 108.13 179.142 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' THR . . . . . 0.821 HG23 ' O ' ' A' ' 24' ' ' LYS . 0.8 OUTLIER 173.53 -41.75 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.294 0.637 . . . . 0.0 110.283 177.605 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 38.3 ttt85 57.91 46.12 17.22 Favored 'General case' 0 CA--C 1.535 0.385 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 -178.099 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 22.5 t80 74.19 126.18 0.04 OUTLIER 'General case' 0 C--N 1.346 0.456 0 C-N-CA 123.615 0.766 . . . . 0.0 110.684 -179.804 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 5.8 m -141.96 168.06 15.17 Favored 'Isoleucine or valine' 0 C--N 1.342 0.254 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 178.766 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -100.59 25.78 7.43 Favored 'General case' 0 CA--C 1.531 0.218 0 N-CA-C 109.897 -0.409 . . . . 0.0 109.897 179.38 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 68.5 -65.81 0.26 Allowed 'General case' 0 C--N 1.352 0.684 0 C-N-CA 123.909 0.883 . . . . 0.0 110.704 -179.398 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 68.1 mt-10 -53.54 -33.71 55.59 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 122.775 0.43 . . . . 0.0 110.803 -179.824 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 9.9 p -66.8 -54.81 18.76 Favored 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 -179.374 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 2.4 tmt_? -55.53 -45.64 77.14 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 110.079 -0.341 . . . . 0.0 110.079 179.821 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 86.6 m-20 -64.43 -48.74 74.2 Favored 'General case' 0 CA--C 1.53 0.199 0 N-CA-C 110.493 -0.188 . . . . 0.0 110.493 -179.073 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -58.04 -43.63 86.91 Favored 'General case' 0 C--N 1.34 0.157 0 N-CA-C 110.336 -0.246 . . . . 0.0 110.336 -179.455 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 21.7 t -56.81 -54.21 32.44 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.214 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 179.913 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 18.0 m95 -60.66 -39.88 90.01 Favored 'General case' 0 N--CA 1.456 -0.154 0 N-CA-C 110.568 -0.16 . . . . 0.0 110.568 -179.532 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -58.83 -52.37 66.01 Favored 'General case' 0 N--CA 1.455 -0.193 0 N-CA-C 109.946 -0.39 . . . . 0.0 109.946 -179.067 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -62.62 -44.52 96.08 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 122.294 0.238 . . . . 0.0 110.508 -179.774 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 29.4 mt -58.12 -39.11 71.45 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.196 0 N-CA-C 110.247 -0.279 . . . . 0.0 110.247 -179.658 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 65.2 mmtt -78.1 -34.11 50.27 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 109.925 -0.398 . . . . 0.0 109.925 -178.901 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -63.85 -58.48 6.66 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 110.407 -0.22 . . . . 0.0 110.407 -178.946 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 79.2 mt -85.62 -2.13 57.85 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 122.223 0.209 . . . . 0.0 110.913 -178.547 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 4.4 m-70 63.71 13.37 7.34 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 123.137 0.575 . . . . 0.0 110.767 -179.42 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 7.6 t80 32.42 57.95 0.39 Allowed 'General case' 0 C--N 1.347 0.472 0 C-N-CA 124.035 0.934 . . . . 0.0 111.153 -178.7 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 13.4 m -77.63 121.01 83.66 Favored Pre-proline 0 CA--C 1.535 0.375 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -69.29 -59.6 0.09 OUTLIER 'Trans proline' 0 N--CA 1.446 -1.28 0 C-N-CA 122.328 2.019 . . . . 0.0 110.027 179.578 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 13.9 m -89.65 -174.02 4.16 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.007 -179.982 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -148.77 -47.54 0.15 Allowed 'General case' 0 C--N 1.341 0.235 0 N-CA-C 109.739 -0.467 . . . . 0.0 109.739 179.682 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.419 ' H ' HG22 ' A' ' 50' ' ' VAL . 5.2 m -73.93 70.8 0.25 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 CA-C-O 121.016 0.436 . . . . 0.0 110.041 179.966 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -161.91 -42.8 0.04 OUTLIER 'General case' 0 N--CA 1.456 -0.17 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 -179.883 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 14.2 ttt85 -146.94 -145.1 0.16 Allowed 'General case' 0 N--CA 1.449 -0.508 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 179.629 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 36.3 t -172.26 -62.22 0.02 OUTLIER 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 108.577 -0.898 . . . . 0.0 108.577 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 10.4 mp -86.27 168.79 13.59 Favored 'General case' 0 N--CA 1.455 -0.225 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 178.634 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 7.2 mtmp? -71.13 -173.63 0.87 Allowed 'General case' 0 C--O 1.235 0.311 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 179.635 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 16.8 m . . . . . 0 C--O 1.257 1.46 0 CA-C-O 116.838 -1.553 . . . . 0.0 109.097 178.21 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 91.6 mtp . . . . . 0 N--CA 1.473 0.699 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 54.87 61.17 3.08 Favored 'General case' 0 C--N 1.344 0.348 0 O-C-N 123.348 0.405 . . . . 0.0 110.191 -179.807 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 17.4 p -123.89 -59.93 1.48 Allowed 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 179.834 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.418 HD13 ' O ' ' A' ' 4' ' ' ILE . 0.1 OUTLIER -56.4 -45.07 81.58 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.437 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 179.913 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 27.1 mmtp -59.52 -58.79 7.04 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 120.733 0.301 . . . . 0.0 110.381 -178.552 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -57.36 -50.64 72.32 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.624 -179.121 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.485 HG22 HD12 ' A' ' 43' ' ' LEU . 29.3 t -53.66 -54.51 18.74 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.092 0 C-N-CA 123.045 0.538 . . . . 0.0 110.491 -179.715 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -55.09 -58.61 6.95 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.728 -177.332 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 32.6 mtmm -59.63 -34.57 72.95 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 110.422 -0.214 . . . . 0.0 110.422 -177.775 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 49.2 tpt85 -64.91 -35.12 80.13 Favored 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 177.061 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -84.56 8.21 17.42 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 122.691 0.396 . . . . 0.0 110.256 178.236 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 61.4 t30 69.98 42.42 1.02 Allowed 'General case' 0 C--N 1.346 0.447 0 C-N-CA 123.974 0.909 . . . . 0.0 111.454 177.424 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 3.6 m -145.16 143.35 22.27 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.518 0 N-CA-C 108.21 -1.033 . . . . 0.0 108.21 176.03 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 74.3 m -71.7 -65.65 0.73 Allowed 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.865 -0.42 . . . . 0.0 109.865 -178.257 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 5.2 t 179.71 -33.02 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 123.964 0.905 . . . . 0.0 108.869 -179.753 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 11.7 p -57.84 -49.08 77.89 Favored 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 178.272 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 12.0 m -56.76 -36.09 69.4 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 110.228 -0.286 . . . . 0.0 110.228 179.215 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 71.6 t -69.99 -38.47 75.42 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.178 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 178.218 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 17.4 m -61.66 -33.36 73.84 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 109.755 -0.461 . . . . 0.0 109.755 179.152 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 50.8 m170 -61.29 -30.48 70.51 Favored 'General case' 0 C--N 1.346 0.431 0 N-CA-C 110.385 -0.228 . . . . 0.0 110.385 179.496 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 93.1 t -63.96 -52.04 61.67 Favored 'Isoleucine or valine' 0 C--N 1.341 0.215 0 N-CA-C 109.522 -0.547 . . . . 0.0 109.522 179.911 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 4.8 mm -64.41 -49.96 78.42 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.164 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 179.656 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 33.8 t-20 -59.86 -31.75 70.06 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 116.528 -0.305 . . . . 0.0 110.205 -179.262 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 31.9 ttpt 64.34 46.02 3.61 Favored 'General case' 0 CA--C 1.532 0.282 0 N-CA-C 109.503 -0.555 . . . . 0.0 109.503 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 15.2 p -115.55 -87.06 0.6 Allowed 'General case' 0 C--N 1.341 0.233 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 -179.847 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 47.5 mmm-85 -94.73 54.6 1.78 Allowed 'General case' 0 C--O 1.233 0.22 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 -179.34 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 27.6 p90 -72.57 144.24 47.98 Favored 'General case' 0 N--CA 1.453 -0.287 0 N-CA-C 109.379 -0.601 . . . . 0.0 109.379 179.7 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 19.7 t -87.54 80.1 1.77 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.286 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 -179.548 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 54.55 -143.33 0.74 Allowed 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.203 179.397 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 69.1 mt-10 -115.05 -25.27 8.2 Favored 'General case' 0 CA--C 1.528 0.125 0 C-N-CA 122.892 0.477 . . . . 0.0 110.284 179.705 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 70.0 mm-40 -55.24 -61.8 2.09 Favored 'General case' 0 C--O 1.232 0.163 0 N-CA-C 110.148 -0.315 . . . . 0.0 110.148 -179.783 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 9.6 m -62.65 -40.1 95.96 Favored 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 179.925 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 13.9 ttm180 -52.03 -48.96 64.3 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 122.701 0.4 . . . . 0.0 110.308 -179.657 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 22.4 t-20 -71.09 -47.52 57.76 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.336 -179.174 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -54.63 -39.79 68.31 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 122.42 0.288 . . . . 0.0 110.945 -178.955 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 17.5 t -60.39 -60.88 1.91 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.279 0 N-CA-C 109.84 -0.43 . . . . 0.0 109.84 -179.524 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 26.0 m95 -58.34 -37.33 74.94 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-O 119.969 -0.062 . . . . 0.0 110.946 -178.196 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -61.37 -55.93 26.07 Favored 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 109.808 -0.442 . . . . 0.0 109.808 179.069 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.5 -42.49 87.78 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 122.611 0.364 . . . . 0.0 110.895 -179.033 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 27.4 mt -52.71 -56.87 5.51 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.193 0 C-N-CA 122.54 0.336 . . . . 0.0 110.703 -178.779 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -83.67 0.09 48.47 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-O 119.6 -0.238 . . . . 0.0 111.541 -176.818 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.6 tm-20 -88.7 -46.48 8.98 Favored 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 109.181 -0.674 . . . . 0.0 109.181 179.435 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.485 HD12 HG22 ' A' ' 7' ' ' VAL . 6.9 mt -72.38 -92.32 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 119.27 -0.395 . . . . 0.0 110.71 -178.514 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 54.9 m80 -158.79 18.0 0.2 Allowed 'General case' 0 C--N 1.352 0.694 0 N-CA-C 112.763 0.653 . . . . 0.0 112.763 -175.608 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 66.7 t80 -67.46 109.98 3.43 Favored 'General case' 0 N--CA 1.464 0.234 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 179.003 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 31.4 t -158.64 85.72 2.41 Favored Pre-proline 0 N--CA 1.453 -0.312 0 N-CA-C 109.826 -0.435 . . . . 0.0 109.826 -179.348 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 10.8 Cg_endo -72.11 76.06 2.2 Favored 'Trans proline' 0 N--CA 1.447 -1.253 0 C-N-CA 122.651 2.234 . . . . 0.0 109.501 178.569 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 12.3 t -93.12 158.22 15.88 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.31 -178.772 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . 63.04 20.96 12.62 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.304 0.642 . . . . 0.0 111.255 179.366 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 26.8 m -144.63 147.03 19.65 Favored 'Isoleucine or valine' 0 C--N 1.341 0.235 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 178.75 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -165.46 -112.19 0.01 OUTLIER 'General case' 0 N--CA 1.455 -0.175 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 179.63 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 17.5 ptm180 -67.19 -24.34 65.85 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 177.738 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 29.5 m -140.18 175.33 9.68 Favored 'General case' 0 C--N 1.344 0.327 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 179.132 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -80.05 176.76 9.46 Favored 'General case' 0 N--CA 1.454 -0.23 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 179.3 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 60.3 pttt -62.68 -25.13 68.0 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 110.396 -0.224 . . . . 0.0 110.396 179.462 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 7.5 p . . . . . 0 C--O 1.253 1.258 0 CA-C-O 116.567 -1.683 . . . . 0.0 108.927 179.574 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 45.1 ttm . . . . . 0 N--CA 1.476 0.861 0 N-CA-C 109.931 -0.396 . . . . 0.0 109.931 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -65.49 80.58 0.06 Allowed 'General case' 0 C--N 1.343 0.292 0 C-N-CA 122.661 0.385 . . . . 0.0 110.899 -178.476 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -156.82 29.33 0.32 Allowed 'General case' 0 N--CA 1.468 0.438 0 N-CA-C 110.111 -0.329 . . . . 0.0 110.111 -179.64 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.1 mt 57.8 24.86 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.625 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 -177.198 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -82.29 -58.06 3.1 Favored 'General case' 0 N--CA 1.45 -0.454 0 C-N-CA 123.412 0.685 . . . . 0.0 110.41 -177.588 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 32.9 m-20 -82.23 -34.24 28.95 Favored 'General case' 0 C--O 1.224 -0.268 0 N-CA-C 110.377 -0.231 . . . . 0.0 110.377 -177.0 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 31.2 t -54.16 -52.56 36.48 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.259 0 N-CA-C 110.092 -0.336 . . . . 0.0 110.092 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.65 -45.73 88.84 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-O 120.499 0.19 . . . . 0.0 110.663 -178.853 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 18.3 mmtp -67.1 -24.71 65.96 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-O 119.614 -0.231 . . . . 0.0 111.224 -178.132 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 1.6 tmm_? -60.65 -43.61 97.38 Favored 'General case' 0 C--N 1.343 0.316 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 177.887 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -85.18 -0.28 54.08 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 178.466 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 67.39 48.73 1.11 Allowed 'General case' 0 C--N 1.345 0.411 0 C-N-CA 123.202 0.601 . . . . 0.0 110.268 178.651 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 27.6 m -143.22 174.1 5.28 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 178.531 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 21.3 m -88.69 161.84 16.62 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 122.672 0.389 . . . . 0.0 110.074 -179.941 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 14.1 t -56.4 -32.35 64.73 Favored 'General case' 0 N--CA 1.463 0.223 0 C-N-CA 122.509 0.324 . . . . 0.0 110.763 -179.851 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 13.8 p -58.86 -45.62 89.69 Favored 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 178.823 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -55.94 -42.35 76.03 Favored 'General case' 0 N--CA 1.453 -0.278 0 N-CA-C 109.884 -0.413 . . . . 0.0 109.884 179.612 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 78.5 t -64.87 -43.47 96.33 Favored 'Isoleucine or valine' 0 C--N 1.34 0.177 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 179.185 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 14.4 t -57.67 -37.25 73.09 Favored 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 110.151 -0.314 . . . . 0.0 110.151 179.622 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 54.7 m170 -59.13 -28.07 66.21 Favored 'General case' 0 C--N 1.344 0.332 0 N-CA-C 110.398 -0.223 . . . . 0.0 110.398 -179.941 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 36.7 t -77.79 -43.69 29.0 Favored 'Isoleucine or valine' 0 C--O 1.232 0.154 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 178.984 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 77.2 mt -57.98 -58.42 6.44 Favored 'Isoleucine or valine' 0 C--N 1.34 0.163 0 N-CA-C 109.519 -0.548 . . . . 0.0 109.519 -179.436 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 26.5 p30 -73.84 -14.42 61.08 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 110.283 -0.266 . . . . 0.0 110.283 -179.849 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 62.22 32.63 17.15 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 122.978 0.511 . . . . 0.0 111.254 177.035 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 14.8 t -70.23 -29.32 66.12 Favored 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 177.56 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 74.3 mtt85 -141.81 98.33 3.32 Favored 'General case' 0 C--N 1.343 0.309 0 N-CA-C 108.115 -1.069 . . . . 0.0 108.115 178.148 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 88.5 t80 -65.88 108.6 2.21 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 110.234 -0.284 . . . . 0.0 110.234 -178.601 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 30.3 m -72.82 172.88 0.96 Allowed 'Isoleucine or valine' 0 N--CA 1.457 -0.118 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 178.235 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -65.03 159.3 23.44 Favored 'General case' 0 N--CA 1.449 -0.477 0 N-CA-C 109.684 -0.487 . . . . 0.0 109.684 178.952 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 29.5 mm-40 -50.63 -43.01 56.86 Favored 'General case' 0 C--O 1.223 -0.336 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.155 179.473 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 9.5 tm-20 -52.17 -53.23 45.68 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 122.217 0.207 . . . . 0.0 110.632 -179.364 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 10.0 m -65.55 -52.66 50.75 Favored 'General case' 0 N--CA 1.442 -0.855 0 CA-C-O 119.593 -0.242 . . . . 0.0 111.453 -175.25 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 6.8 ppt_? -62.19 -39.51 92.97 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 118.277 0.49 . . . . 0.0 110.958 -176.784 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 49.2 m-80 -67.17 -46.61 73.47 Favored 'General case' 0 C--N 1.34 0.194 0 N-CA-C 109.549 -0.537 . . . . 0.0 109.549 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -58.64 -42.01 87.36 Favored 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 110.21 -0.293 . . . . 0.0 110.21 179.717 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 18.8 t -63.94 -58.3 7.92 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.216 0 C-N-CA 122.381 0.272 . . . . 0.0 110.314 -179.514 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 19.3 m95 -57.87 -37.76 74.51 Favored 'General case' 0 C--N 1.342 0.261 0 N-CA-C 110.444 -0.206 . . . . 0.0 110.444 -178.371 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -64.13 -52.55 58.59 Favored 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 179.266 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -55.74 -45.46 78.0 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 122.449 0.3 . . . . 0.0 111.038 -178.602 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 46.5 mt -55.26 -43.53 71.33 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 C-N-CA 122.2 0.2 . . . . 0.0 110.985 -178.116 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 36.6 mtmm -78.32 -43.54 27.61 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 109.983 -0.377 . . . . 0.0 109.983 -177.541 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 24.0 mm-40 -57.15 -47.77 80.36 Favored 'General case' 0 N--CA 1.448 -0.542 0 O-C-N 123.152 0.282 . . . . 0.0 110.761 -178.466 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -85.52 -0.68 55.69 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-O 119.669 -0.205 . . . . 0.0 110.636 -178.876 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 21.2 m80 57.14 38.47 29.01 Favored 'General case' 0 C--N 1.345 0.406 0 C-N-CA 122.651 0.38 . . . . 0.0 110.689 178.687 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 1.5 m-85 -58.64 108.23 0.61 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.258 179.791 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 23.1 t -130.99 79.95 70.41 Favored Pre-proline 0 N--CA 1.449 -0.479 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 178.025 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 3.6 Cg_exo -59.79 154.62 48.42 Favored 'Trans proline' 0 N--CA 1.449 -1.104 0 C-N-CA 122.536 2.157 . . . . 0.0 110.332 -179.223 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' SER . . . . . 0.401 ' O ' ' HB3' ' A' ' 49' ' ' ALA . 4.7 t 73.78 105.12 0.07 Allowed 'General case' 0 C--N 1.344 0.359 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 -178.395 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.401 ' HB3' ' O ' ' A' ' 48' ' ' SER . . . 69.84 -175.44 0.19 Allowed 'General case' 0 C--N 1.341 0.231 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 -178.204 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 4.1 t 51.77 55.36 0.36 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 -179.014 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -77.77 73.67 4.33 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 116.174 -0.466 . . . . 0.0 109.901 -179.103 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 51.9 ttt180 76.65 -55.48 0.57 Allowed 'General case' 0 C--N 1.343 0.307 0 C-N-CA 123.477 0.711 . . . . 0.0 110.22 179.415 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 16.5 m 56.71 63.71 1.87 Allowed 'General case' 0 C--N 1.342 0.24 0 C-N-CA 122.722 0.409 . . . . 0.0 110.305 179.166 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 43.8 mt -59.75 146.91 39.81 Favored 'General case' 0 C--O 1.232 0.141 0 N-CA-C 109.827 -0.435 . . . . 0.0 109.827 179.887 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -159.76 41.73 0.2 Allowed 'General case' 0 CA--C 1.531 0.214 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 -179.784 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 57.2 t . . . . . 0 C--O 1.253 1.258 0 CA-C-O 116.658 -1.639 . . . . 0.0 108.831 -179.853 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 51.7 tpp . . . . . 0 N--CA 1.472 0.655 0 N-CA-C 109.63 -0.507 . . . . 0.0 109.63 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -137.38 81.01 1.84 Allowed 'General case' 0 C--N 1.341 0.202 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 -179.607 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 47.3 p -127.19 175.2 8.32 Favored 'General case' 0 CA--C 1.531 0.216 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 179.636 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 21.3 tt -55.12 -32.47 27.76 Favored 'Isoleucine or valine' 0 C--N 1.344 0.369 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 179.144 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -60.47 -60.25 4.11 Favored 'General case' 0 N--CA 1.447 -0.608 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 178.993 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 29.2 m-20 -54.22 -43.36 70.75 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.262 179.379 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 42.8 t -59.53 -36.67 66.12 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.28 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 178.409 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -68.11 -40.04 82.63 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 110.273 -0.269 . . . . 0.0 110.273 179.755 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 52.9 mttt -62.48 -40.44 96.69 Favored 'General case' 0 C--N 1.343 0.289 0 N-CA-C 108.485 -0.931 . . . . 0.0 108.485 177.733 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 27.1 mtt180 -60.03 -43.58 95.2 Favored 'General case' 0 C--N 1.341 0.229 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 176.415 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -73.77 9.85 1.33 Allowed 'General case' 0 CA--C 1.541 0.635 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.632 177.023 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 8.1 m-80 75.07 149.19 0.1 Allowed 'General case' 0 C--N 1.353 0.739 0 C-N-CA 124.296 1.038 . . . . 0.0 111.613 177.199 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 40.8 t 64.02 -86.6 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.455 -0.18 0 CA-C-N 114.393 -1.276 . . . . 0.0 110.559 177.116 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 9.3 t -174.88 -162.74 0.12 Allowed 'General case' 0 C--O 1.233 0.234 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 -177.045 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 20.0 p -57.91 -19.93 33.49 Favored 'General case' 0 C--O 1.222 -0.347 0 C-N-CA 123.133 0.573 . . . . 0.0 111.314 -179.282 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 4.6 m -53.5 -49.51 67.38 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 110.277 -0.268 . . . . 0.0 110.277 179.668 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 26.1 m -62.4 -44.3 96.78 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 110.296 -0.261 . . . . 0.0 110.296 -179.289 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 92.6 t -61.29 -42.25 92.84 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 -179.839 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 50.3 m -61.3 -40.72 95.21 Favored 'General case' 0 N--CA 1.454 -0.243 0 N-CA-C 110.159 -0.311 . . . . 0.0 110.159 -179.496 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 47.0 m170 -59.36 -41.3 88.93 Favored 'General case' 0 C--N 1.339 0.149 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 -179.825 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 54.0 t -70.47 -52.48 28.93 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 O-C-N 123.035 0.21 . . . . 0.0 110.791 -178.674 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 93.1 mt -63.44 -51.87 65.22 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 N-CA-C 110.393 -0.225 . . . . 0.0 110.393 -177.635 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 14.6 t-20 -68.56 -34.88 76.6 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-O 119.665 -0.207 . . . . 0.0 110.517 -178.483 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 23.1 mtmm 70.56 60.09 0.22 Allowed 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 123.373 0.669 . . . . 0.0 109.507 -179.398 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 19.3 p -87.33 -80.35 0.26 Allowed 'General case' 0 C--N 1.34 0.167 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 179.201 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 8.7 ptm180 -86.76 163.1 17.48 Favored 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 109.843 -0.429 . . . . 0.0 109.843 179.41 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 89.1 t80 -80.99 142.25 33.62 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 179.617 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 9.0 m -141.17 158.19 22.61 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.183 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 178.544 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -73.22 160.2 32.28 Favored 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 179.499 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 15.1 mm-40 -58.53 -24.38 60.47 Favored 'General case' 0 C--O 1.223 -0.298 0 N-CA-C 110.099 -0.334 . . . . 0.0 110.099 179.071 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.7 tm-20 -56.21 -53.01 62.28 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 109.705 -0.48 . . . . 0.0 109.705 178.034 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 3.9 m -64.03 -48.68 75.35 Favored 'General case' 0 N--CA 1.449 -0.517 0 C-N-CA 122.247 0.219 . . . . 0.0 110.477 -177.487 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 28.3 mtm180 -57.84 -54.25 48.99 Favored 'General case' 0 CA--C 1.528 0.119 0 N-CA-C 110.051 -0.351 . . . . 0.0 110.051 -179.16 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 48.6 t30 -57.73 -48.82 78.51 Favored 'General case' 0 C--O 1.224 -0.272 0 C-N-CA 122.785 0.434 . . . . 0.0 110.339 -178.828 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -55.85 -47.16 77.77 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 122.112 0.165 . . . . 0.0 110.651 -178.968 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 39.2 t -63.44 -56.4 17.29 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.15 0 N-CA-C 110.474 -0.195 . . . . 0.0 110.474 -178.82 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 19.5 m95 -57.21 -40.19 76.99 Favored 'General case' 0 C--O 1.233 0.202 0 N-CA-C 110.516 -0.179 . . . . 0.0 110.516 -178.56 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -64.09 -49.59 71.65 Favored 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 -179.781 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -70.44 0.15 7.21 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-O 119.499 -0.286 . . . . 0.0 111.536 -178.68 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 21.8 mt -102.91 -46.72 10.83 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.195 0 N-CA-C 109.899 -0.408 . . . . 0.0 109.899 178.895 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 1.1 ttpm? -93.19 -30.35 15.26 Favored 'General case' 0 C--N 1.343 0.318 0 N-CA-C 112.25 0.463 . . . . 0.0 112.25 -176.078 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 49.5 mm-40 -86.46 -30.56 21.93 Favored 'General case' 0 C--N 1.34 0.172 0 CA-C-N 118.371 0.532 . . . . 0.0 110.558 -177.72 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -73.76 -29.1 62.02 Favored 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 110.356 -0.239 . . . . 0.0 110.356 -179.323 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 19.1 m80 59.57 57.73 3.16 Favored 'General case' 0 C--N 1.346 0.426 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 -179.481 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 9.2 p90 -71.6 17.25 0.09 Allowed 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.896 -178.631 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 34.0 t 55.14 69.94 1.81 Allowed Pre-proline 0 CA--C 1.536 0.404 0 C-N-CA 122.913 0.485 . . . . 0.0 110.416 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_exo -57.45 127.64 26.28 Favored 'Trans proline' 0 N--CA 1.448 -1.186 0 C-N-CA 122.525 2.15 . . . . 0.0 110.214 179.053 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 17.3 m -79.9 53.77 1.73 Allowed 'General case' 0 CA--C 1.53 0.202 0 N-CA-C 110.387 -0.227 . . . . 0.0 110.387 -179.186 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -69.18 -44.73 71.6 Favored 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 179.345 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 53.3 t -70.4 -30.47 43.13 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.204 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 179.313 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 56.27 51.78 11.15 Favored 'General case' 0 C--N 1.345 0.412 0 C-N-CA 122.869 0.468 . . . . 0.0 110.087 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 10.6 tpt85 -155.83 -138.6 0.07 Allowed 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 179.708 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 58.1 p -158.49 128.25 5.83 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 -179.714 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 5.5 tt -62.45 -41.46 98.76 Favored 'General case' 0 CA--C 1.531 0.223 0 N-CA-C 110.221 -0.288 . . . . 0.0 110.221 -179.536 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 22.1 mmmt 56.21 73.83 0.42 Allowed 'General case' 0 C--N 1.347 0.46 0 C-N-CA 122.919 0.488 . . . . 0.0 110.327 179.775 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 8.8 p . . . . . 0 C--O 1.254 1.313 0 CA-C-O 117.117 -1.421 . . . . 0.0 109.704 179.113 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.7 mpt? . . . . . 0 N--CA 1.472 0.663 0 N-CA-C 110.037 -0.357 . . . . 0.0 110.037 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -84.74 69.61 10.7 Favored 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 179.53 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 22.9 p -138.36 163.43 31.87 Favored 'General case' 0 CA--C 1.519 -0.212 0 CA-C-O 121.077 0.465 . . . . 0.0 110.497 -179.412 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -58.0 -29.62 36.71 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.406 0 CA-C-N 115.336 -0.847 . . . . 0.0 109.774 176.594 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 28.9 mtpp -58.51 -64.92 0.75 Allowed 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 122.492 0.317 . . . . 0.0 110.757 -178.763 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -58.9 -44.85 91.28 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.64 -0.254 . . . . 0.0 110.623 -179.379 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 53.5 t -56.53 -45.2 82.07 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 179.577 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.6 -45.09 91.92 Favored 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 110.397 -0.224 . . . . 0.0 110.397 -179.74 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 34.9 mtmm -58.55 -41.49 85.71 Favored 'General case' 0 C--N 1.341 0.237 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 178.512 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.43 -35.23 76.98 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 108.748 -0.834 . . . . 0.0 108.748 177.911 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -88.58 15.64 7.76 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.471 178.458 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 64.2 t30 85.26 145.91 0.06 Allowed 'General case' 0 C--N 1.353 0.738 0 C-N-CA 124.281 1.032 . . . . 0.0 111.487 177.74 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 4.9 t 65.24 -116.6 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.471 0 CA-C-N 114.907 -1.042 . . . . 0.0 109.814 178.461 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 7.9 t -166.25 -161.69 0.49 Allowed 'General case' 0 C--N 1.344 0.341 0 CA-C-N 118.491 0.587 . . . . 0.0 110.247 -178.758 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 39.1 p -54.26 -23.32 14.41 Favored 'General case' 0 C--N 1.342 0.261 0 C-N-CA 123.189 0.596 . . . . 0.0 111.744 -177.881 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 13.2 t -56.2 -38.53 71.11 Favored 'General case' 0 C--O 1.222 -0.385 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 179.257 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 58.0 m -65.72 -35.32 80.42 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 109.922 -0.399 . . . . 0.0 109.922 179.767 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 62.3 t -69.98 -52.71 28.48 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.336 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 179.868 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 85.3 p -53.42 -40.31 65.02 Favored 'General case' 0 C--N 1.343 0.298 0 N-CA-C 110.524 -0.176 . . . . 0.0 110.524 -178.634 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 57.7 m170 -54.05 -36.41 63.04 Favored 'General case' 0 C--N 1.345 0.386 0 C-N-CA 122.27 0.228 . . . . 0.0 110.396 179.112 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 59.2 t -78.49 -35.02 18.57 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.224 0 CA-C-N 116.687 -0.233 . . . . 0.0 110.397 -179.288 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 25.5 mm -67.23 -50.84 59.4 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.218 0 CA-C-N 117.889 0.313 . . . . 0.0 110.214 -179.285 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 34.6 p30 -87.27 -8.67 56.52 Favored 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 111.674 0.25 . . . . 0.0 111.674 -177.645 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 54.25 36.75 25.84 Favored 'General case' 0 C--N 1.345 0.399 0 C-N-CA 122.616 0.367 . . . . 0.0 110.388 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 7.0 t -82.12 -30.1 31.34 Favored 'General case' 0 CA--C 1.531 0.247 0 N-CA-C 110.307 -0.257 . . . . 0.0 110.307 -179.291 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 60.1 mtp85 -128.31 116.95 20.61 Favored 'General case' 0 C--N 1.344 0.344 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 47.4 t80 -71.72 108.38 5.02 Favored 'General case' 0 N--CA 1.453 -0.285 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 -179.668 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 4.6 m -107.35 38.55 0.37 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.376 0 C-N-CA 122.551 0.341 . . . . 0.0 110.549 -178.96 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 60.73 -179.91 0.1 Allowed 'General case' 0 C--N 1.343 0.302 0 CA-C-O 121.111 0.482 . . . . 0.0 111.179 178.869 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 58.1 mm-40 -77.77 -25.64 49.23 Favored 'General case' 0 C--O 1.223 -0.298 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.286 179.693 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -58.3 -64.92 0.75 Allowed 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 110.471 -0.196 . . . . 0.0 110.471 -178.666 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 2.2 m -61.26 -44.29 97.48 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 110.091 -0.337 . . . . 0.0 110.091 -178.674 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 44.1 ttm105 -53.54 -55.8 22.49 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 122.826 0.451 . . . . 0.0 110.613 -179.336 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -63.36 -48.03 79.65 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 122.424 0.289 . . . . 0.0 110.496 -178.873 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.65 -47.32 70.46 Favored 'General case' 0 C--N 1.34 0.157 0 C-N-CA 122.187 0.195 . . . . 0.0 110.674 -178.972 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 37.9 t -62.78 -57.41 12.16 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.223 0 N-CA-C 110.173 -0.306 . . . . 0.0 110.173 -179.484 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 13.1 m95 -56.57 -32.13 64.89 Favored 'General case' 0 C--N 1.343 0.283 0 CA-C-N 117.463 0.119 . . . . 0.0 110.946 -178.235 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -71.59 -67.48 0.52 Allowed 'General case' 0 N--CA 1.447 -0.581 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 179.075 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -48.08 -40.54 23.58 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 122.692 0.397 . . . . 0.0 111.555 -178.11 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 1.5 mm -44.71 -54.4 1.23 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.206 0 C-N-CA 123.095 0.558 . . . . 0.0 111.27 -178.326 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 24.3 pttm -100.84 -31.78 10.99 Favored 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 112.187 0.44 . . . . 0.0 112.187 -176.112 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 76.1 mm-40 -73.5 -40.19 64.25 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 118.04 0.382 . . . . 0.0 110.989 -176.989 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.0 tt -77.33 -36.43 53.93 Favored 'General case' 0 CA--C 1.527 0.084 0 N-CA-C 110.179 -0.304 . . . . 0.0 110.179 -178.688 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 15.2 m80 76.93 134.28 0.06 Allowed 'General case' 0 C--N 1.346 0.444 0 C-N-CA 123.619 0.768 . . . . 0.0 109.735 -178.975 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 3.7 p90 -146.91 152.27 38.41 Favored 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 178.301 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' SER . . . . . 0.412 ' CB ' ' HD3' ' A' ' 47' ' ' PRO . 1.7 m -49.18 -65.66 0.77 Allowed Pre-proline 0 CA--C 1.543 0.691 0 CA-C-O 118.543 -0.741 . . . . 0.0 112.581 -174.735 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' PRO . . . . . 0.412 ' HD3' ' CB ' ' A' ' 46' ' ' SER . 17.5 Cg_endo -69.63 72.73 1.36 Allowed 'Trans proline' 0 C--N 1.359 1.11 0 C-N-CA 122.225 1.95 . . . . 0.0 111.049 -179.605 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 22.3 t -137.8 146.17 43.22 Favored 'General case' 0 N--CA 1.455 -0.193 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 179.887 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -73.52 -45.09 55.79 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.31 -179.513 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 8.9 t -81.53 63.39 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.294 0 N-CA-C 109.806 -0.442 . . . . 0.0 109.806 -178.653 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -83.88 52.75 2.36 Favored 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 178.853 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 12.3 mmm180 -113.69 -38.65 4.23 Favored 'General case' 0 C--N 1.34 0.192 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 -178.956 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 41.4 m -77.08 66.96 2.98 Favored 'General case' 0 N--CA 1.455 -0.187 0 N-CA-C 109.973 -0.38 . . . . 0.0 109.973 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 28.0 mt -70.19 -49.21 52.59 Favored 'General case' 0 N--CA 1.455 -0.187 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 -179.897 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -158.08 160.81 37.77 Favored 'General case' 0 N--CA 1.452 -0.326 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 179.633 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 58.4 t . . . . . 0 C--O 1.249 1.028 0 CA-C-O 116.586 -1.673 . . . . 0.0 109.625 -179.318 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.8 tmt? . . . . . 0 N--CA 1.471 0.598 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -162.2 155.86 21.01 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 179.621 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.1 p -107.95 157.4 18.24 Favored 'General case' 0 N--CA 1.453 -0.275 0 C-N-CA 122.684 0.394 . . . . 0.0 110.145 -178.837 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -59.43 -28.28 39.33 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.286 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.246 -179.691 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 58.2 mtmt -48.43 -63.05 1.19 Allowed 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 122.947 0.499 . . . . 0.0 110.583 179.41 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -58.38 -44.97 89.15 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.722 -178.45 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 97.1 t -57.12 -43.34 81.27 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.184 0 N-CA-C 110.319 -0.252 . . . . 0.0 110.319 -179.168 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.71 -40.08 93.78 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 122.386 0.275 . . . . 0.0 110.715 -178.702 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -64.65 -49.32 71.47 Favored 'General case' 0 C--O 1.227 -0.125 0 N-CA-C 109.521 -0.548 . . . . 0.0 109.521 179.447 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.38 -31.76 73.1 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.258 179.844 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -71.41 -53.22 14.79 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 122.241 0.216 . . . . 0.0 110.635 -178.987 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 42.7 t30 -147.94 -82.65 0.12 Allowed 'General case' 0 C--N 1.342 0.264 0 CA-C-O 119.682 -0.199 . . . . 0.0 111.06 -177.851 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 95.2 t -140.68 -66.87 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.348 0.514 0 CA-C-N 117.68 0.218 . . . . 0.0 110.911 -176.958 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 74.4 m -132.43 172.48 12.42 Favored 'General case' 0 C--N 1.344 0.365 0 CA-C-O 120.995 0.426 . . . . 0.0 110.892 -176.999 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 43.0 p -53.91 -31.72 51.04 Favored 'General case' 0 C--O 1.223 -0.314 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.438 -178.696 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 12.8 t -49.4 -44.8 45.45 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 122.099 0.159 . . . . 0.0 110.936 -178.992 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 6.6 m -57.52 -28.83 63.82 Favored 'General case' 0 C--N 1.342 0.281 0 CA-C-O 119.687 -0.197 . . . . 0.0 111.116 -178.756 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 40.2 t -88.33 -37.08 9.99 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.223 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 179.098 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 25.4 m -57.08 -45.86 82.97 Favored 'General case' 0 CA--C 1.519 -0.233 0 C-N-CA 122.474 0.31 . . . . 0.0 110.473 -177.347 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 52.9 m-70 -56.13 -43.16 77.93 Favored 'General case' 0 C--O 1.209 -1.064 0 N-CA-C 110.177 -0.305 . . . . 0.0 110.177 -179.497 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 3.2 t -58.27 -29.5 37.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 O-C-N 121.9 -0.5 . . . . 0.0 112.325 -176.204 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 2.7 mt -79.85 -29.41 12.89 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.462 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 -176.239 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 6.4 p30 -117.37 -33.7 4.54 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 118.613 0.642 . . . . 0.0 112.168 -175.488 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 174.08 102.9 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 -177.521 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 65.5 p -48.83 -33.34 10.32 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 112.722 0.638 . . . . 0.0 112.722 -177.609 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 74.68 -164.0 0.08 Allowed 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 -177.148 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.1 t80 -79.24 96.14 5.84 Favored 'General case' 0 CA--C 1.531 0.232 0 O-C-N 122.249 -0.282 . . . . 0.0 110.779 -178.209 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 1.6 m -149.22 151.21 13.2 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.236 0 N-CA-C 108.576 -0.898 . . . . 0.0 108.576 176.9 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.88 153.66 42.99 Favored 'General case' 0 N--CA 1.447 -0.605 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 178.855 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 38.3 mp0 -55.21 -34.09 63.64 Favored 'General case' 0 CA--C 1.527 0.088 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 179.589 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -53.84 -41.84 67.84 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 122.66 0.384 . . . . 0.0 110.804 -179.857 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 1.7 m -66.22 -22.73 66.35 Favored 'General case' 0 C--N 1.346 0.432 0 N-CA-C 110.234 -0.284 . . . . 0.0 110.234 -178.202 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 3.0 mmp_? -85.07 -47.03 10.59 Favored 'General case' 0 C--N 1.343 0.312 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 179.762 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 28.2 m120 -54.19 -43.66 70.91 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 179.51 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -58.02 -41.61 83.51 Favored 'General case' 0 N--CA 1.453 -0.307 0 O-C-N 123.165 0.291 . . . . 0.0 111.317 -179.523 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 38.4 t -66.16 -57.17 11.5 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.195 0 CA-C-N 117.609 0.186 . . . . 0.0 110.551 -177.919 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 33.9 m95 -65.45 -30.77 71.6 Favored 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 110.719 -0.104 . . . . 0.0 110.719 -177.315 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -67.24 -51.12 57.05 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 177.505 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.23 -41.55 84.36 Favored 'General case' 0 C--N 1.342 0.266 0 C-N-CA 122.362 0.265 . . . . 0.0 110.334 179.74 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 3.2 mm -54.39 -50.82 54.53 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.272 0 C-N-CA 122.788 0.435 . . . . 0.0 110.315 179.782 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 20.4 tptm -74.11 -33.16 63.49 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 110.243 -0.28 . . . . 0.0 110.243 -178.014 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -63.96 -63.35 1.18 Allowed 'General case' 0 N--CA 1.448 -0.539 0 C-N-CA 122.368 0.267 . . . . 0.0 110.947 -177.61 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 82.3 mt -83.49 -20.79 33.32 Favored 'General case' 0 C--N 1.338 0.088 0 CA-C-O 119.47 -0.3 . . . . 0.0 111.503 -176.768 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 73.87 138.47 0.06 Allowed 'General case' 0 C--N 1.345 0.407 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 -178.279 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 8.7 t80 -125.21 142.01 51.75 Favored 'General case' 0 C--N 1.333 -0.126 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 179.487 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 1.7 t -105.77 111.15 64.69 Favored Pre-proline 0 CA--C 1.539 0.535 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 179.049 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 8.6 Cg_endo -68.67 -172.59 0.48 Allowed 'Trans proline' 0 N--CA 1.453 -0.856 0 C-N-CA 122.526 2.151 . . . . 0.0 110.821 -179.753 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 15.4 m -47.53 -42.16 22.75 Favored 'General case' 0 C--N 1.346 0.441 0 N-CA-C 109.941 -0.392 . . . . 0.0 109.941 178.892 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -76.58 84.75 3.26 Favored 'General case' 0 N--CA 1.449 -0.498 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 176.947 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 86.5 t -48.49 120.35 0.84 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.175 0 C-N-CA 122.748 0.419 . . . . 0.0 110.083 -178.461 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -77.69 70.51 4.07 Favored 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 179.781 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 20.7 tpt180 -58.68 -33.09 69.75 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 122.617 0.367 . . . . 0.0 110.305 -179.633 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 22.8 t -62.67 -31.38 72.26 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 122.295 0.238 . . . . 0.0 110.384 179.869 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 73.4 mt 55.39 -105.07 0.25 Allowed 'General case' 0 C--N 1.347 0.459 0 C-N-CA 122.907 0.483 . . . . 0.0 109.886 -179.309 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 39.5 ttmt -159.65 143.55 14.66 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 61.7 t . . . . . 0 C--O 1.254 1.293 0 CA-C-O 116.541 -1.695 . . . . 0.0 108.838 179.637 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.2 tmt? . . . . . 0 N--CA 1.472 0.642 0 N-CA-C 110.02 -0.363 . . . . 0.0 110.02 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -161.1 59.18 0.3 Allowed 'General case' 0 C--N 1.341 0.235 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 179.598 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 40.2 p -124.27 -178.58 4.14 Favored 'General case' 0 CA--C 1.517 -0.309 0 CA-C-O 121.385 0.612 . . . . 0.0 110.306 -179.792 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 33.9 pt -57.35 -25.02 22.77 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.776 0 CA-C-N 115.033 -0.985 . . . . 0.0 109.673 176.265 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 36.5 mtpt -65.71 -63.11 1.17 Allowed 'General case' 0 N--CA 1.448 -0.536 0 N-CA-C 109.549 -0.537 . . . . 0.0 109.549 179.903 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -49.41 -49.83 43.19 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.447 178.843 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 64.4 t -58.78 -51.75 68.33 Favored 'Isoleucine or valine' 0 C--N 1.341 0.224 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.299 -179.239 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -55.6 -54.56 42.62 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 122.28 0.232 . . . . 0.0 110.64 -178.726 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 61.9 mtpt -58.83 -38.85 79.61 Favored 'General case' 0 N--CA 1.453 -0.283 0 O-C-N 123.113 0.258 . . . . 0.0 110.457 -178.371 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 14.1 tpt180 -63.41 -36.82 84.98 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 177.701 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -82.75 7.86 13.83 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 122.417 0.287 . . . . 0.0 110.241 177.862 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 76.53 -35.79 0.25 Allowed 'General case' 0 C--N 1.35 0.591 0 C-N-CA 124.144 0.977 . . . . 0.0 111.888 177.823 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.416 HG23 ' H ' ' A' ' 13' ' ' VAL . 0.0 OUTLIER -78.05 -170.99 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 CA-C-N 118.321 0.509 . . . . 0.0 110.384 -178.003 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 11.2 t -102.93 179.78 4.18 Favored 'General case' 0 C--N 1.345 0.372 0 C-N-CA 122.824 0.45 . . . . 0.0 110.439 -178.468 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 19.4 p -58.02 -29.21 65.14 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 123.106 0.562 . . . . 0.0 111.644 -177.372 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 12.5 t -53.91 -38.23 64.62 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 117.814 0.279 . . . . 0.0 110.667 -179.298 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' THR . . . . . 0.522 ' O ' HG23 ' A' ' 21' ' ' VAL . 87.2 m -67.4 -36.68 81.78 Favored 'General case' 0 N--CA 1.451 -0.393 0 O-C-N 122.168 -0.332 . . . . 0.0 110.152 -179.361 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 66.7 t -73.96 -41.02 53.0 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 N-CA-C 109.931 -0.396 . . . . 0.0 109.931 -179.62 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 94.0 p -59.88 -41.31 91.28 Favored 'General case' 0 N--CA 1.453 -0.278 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 179.021 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 55.2 m170 -56.5 -35.45 68.03 Favored 'General case' 0 C--N 1.346 0.436 0 N-CA-C 110.085 -0.339 . . . . 0.0 110.085 177.827 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.549 HG22 ' HD2' ' A' ' 33' ' ' ARG . 99.4 t -72.94 -57.79 6.27 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.162 0 C-N-CA 122.376 0.27 . . . . 0.0 110.68 -177.714 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 34.2 mm -57.0 -48.46 81.69 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.157 0 N-CA-C 110.368 -0.234 . . . . 0.0 110.368 -177.509 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 34.9 m-80 -73.8 -28.86 61.85 Favored 'General case' 0 CA--C 1.53 0.192 0 N-CA-C 110.496 -0.187 . . . . 0.0 110.496 -179.27 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 34.3 ttpt 57.01 53.72 7.72 Favored 'General case' 0 C--N 1.344 0.327 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 -179.124 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 13.9 t -108.46 -43.3 4.35 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.849 -177.432 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 27.0 tpt180 -85.54 109.66 18.67 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 109.408 -0.59 . . . . 0.0 109.408 -179.013 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 66.4 t80 -64.64 144.68 57.05 Favored 'General case' 0 N--CA 1.456 -0.149 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.268 -179.802 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 5.5 m -147.81 -171.05 0.25 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 -179.567 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -85.53 28.89 0.72 Allowed 'General case' 0 CA--C 1.539 0.526 0 CA-C-O 119.621 -0.228 . . . . 0.0 111.322 -179.325 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 72.56 -65.64 0.34 Allowed 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 123.427 0.691 . . . . 0.0 111.564 178.086 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -42.76 -47.13 5.39 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.355 0.662 . . . . 0.0 111.599 -176.872 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 6.6 m -50.48 -39.95 49.62 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 122.426 0.29 . . . . 0.0 111.026 -179.195 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.549 ' HD2' HG22 ' A' ' 21' ' ' VAL . 3.4 mpt_? -82.38 -42.45 18.64 Favored 'General case' 0 N--CA 1.46 0.058 0 N-CA-C 109.992 -0.373 . . . . 0.0 109.992 -178.789 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 20.2 t30 -54.41 -43.45 71.5 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 110.014 -0.365 . . . . 0.0 110.014 179.364 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -56.98 -49.0 77.09 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 122.537 0.335 . . . . 0.0 110.272 179.858 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 84.8 t -62.85 -49.28 84.28 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 N-CA-C 109.824 -0.436 . . . . 0.0 109.824 179.998 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 18.4 m95 -53.84 -40.27 66.31 Favored 'General case' 0 C--N 1.341 0.236 0 N-CA-C 110.05 -0.352 . . . . 0.0 110.05 179.767 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -66.55 -47.59 72.36 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 178.41 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -53.75 -39.57 65.45 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 122.425 0.29 . . . . 0.0 110.974 -179.482 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 1.1 mp -53.69 -39.75 39.84 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.384 0 N-CA-C 110.231 -0.285 . . . . 0.0 110.231 179.792 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 57.4 tptt -86.71 -40.25 15.23 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 122.244 0.218 . . . . 0.0 110.744 -177.328 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 47.2 mm-40 -61.68 -51.8 66.94 Favored 'General case' 0 N--CA 1.456 -0.175 0 N-CA-C 110.04 -0.355 . . . . 0.0 110.04 -177.696 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 61.3 tp -83.78 -82.54 0.16 Allowed 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 179.571 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 2.5 p-80 161.8 145.31 0.01 OUTLIER 'General case' 0 C--N 1.345 0.372 0 C-N-CA 124.24 1.016 . . . . 0.0 108.589 -179.835 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 29.5 t80 -161.6 147.49 13.85 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 178.887 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 46.9 t -118.16 88.88 33.62 Favored Pre-proline 0 CA--C 1.534 0.363 0 C-N-CA 122.565 0.346 . . . . 0.0 110.233 -178.819 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo -64.3 -53.78 1.02 Allowed 'Trans proline' 0 N--CA 1.447 -1.22 0 C-N-CA 122.433 2.088 . . . . 0.0 110.13 178.619 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 43.3 t -161.99 150.22 14.94 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 109.298 -0.63 . . . . 0.0 109.298 -179.972 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -72.22 -42.69 65.44 Favored 'General case' 0 N--CA 1.451 -0.387 0 N-CA-C 109.619 -0.511 . . . . 0.0 109.619 179.39 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 28.1 t 68.3 149.03 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.349 0.547 0 C-N-CA 123.682 0.793 . . . . 0.0 110.281 -179.909 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -78.13 71.76 4.62 Favored 'General case' 0 N--CA 1.454 -0.225 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 179.6 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 80.2 mtt-85 -78.22 63.94 3.25 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 109.893 -0.41 . . . . 0.0 109.893 -179.428 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 77.4 p -84.82 -176.23 6.12 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 109.546 -0.539 . . . . 0.0 109.546 179.533 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 11.2 tp 56.43 72.54 0.49 Allowed 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 122.719 0.408 . . . . 0.0 109.935 179.612 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 4.8 mptp? -73.53 128.21 34.87 Favored 'General case' 0 N--CA 1.454 -0.262 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 179.694 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 95.2 t . . . . . 0 C--O 1.252 1.22 0 CA-C-O 116.818 -1.563 . . . . 0.0 108.764 179.515 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 72.3 mtm . . . . . 0 N--CA 1.472 0.663 0 N-CA-C 110.027 -0.361 . . . . 0.0 110.027 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -62.52 153.64 31.16 Favored 'General case' 0 C--O 1.235 0.298 0 N-CA-C 110.051 -0.351 . . . . 0.0 110.051 179.917 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 18.4 p -111.03 175.4 5.43 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 20.2 tt -56.69 -31.77 35.89 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.304 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 179.4 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 9.0 mtmp? -59.75 -65.84 0.61 Allowed 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 122.575 0.35 . . . . 0.0 110.125 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -54.96 -51.3 66.61 Favored 'General case' 0 N--CA 1.456 -0.147 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.513 -178.698 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 55.0 t -55.99 -49.86 72.92 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 C-N-CA 122.658 0.383 . . . . 0.0 110.643 -178.196 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.0 -50.47 70.61 Favored 'General case' 0 N--CA 1.456 -0.168 0 C-N-CA 122.175 0.19 . . . . 0.0 111.186 -177.743 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 41.9 tttm -62.08 -36.03 80.46 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 122.071 0.149 . . . . 0.0 110.624 -178.024 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 21.7 tpp180 -72.44 -41.25 66.36 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 109.754 -0.462 . . . . 0.0 109.754 179.588 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -64.89 -57.42 8.85 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 122.541 0.337 . . . . 0.0 111.129 -178.384 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 22.1 m120 -135.74 -121.36 0.16 Allowed 'General case' 0 C--N 1.342 0.253 0 N-CA-C 110.299 -0.26 . . . . 0.0 110.299 -177.22 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 94.5 t -87.69 -58.8 3.17 Favored 'Isoleucine or valine' 0 C--N 1.342 0.266 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 -178.351 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 52.4 p -167.48 -164.04 0.56 Allowed 'General case' 0 C--O 1.232 0.155 0 N-CA-C 109.912 -0.403 . . . . 0.0 109.912 -179.06 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 27.9 m -56.88 -27.39 60.45 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.557 179.914 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 23.5 p -59.79 -54.56 44.81 Favored 'General case' 0 C--N 1.341 0.236 0 N-CA-C 110.068 -0.345 . . . . 0.0 110.068 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -62.57 -20.91 65.17 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-O 119.52 -0.276 . . . . 0.0 111.084 -179.337 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 39.4 t -82.04 -53.27 12.29 Favored 'Isoleucine or valine' 0 C--N 1.34 0.178 0 CA-C-N 118.028 0.377 . . . . 0.0 110.035 179.272 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 84.2 p -50.87 -38.42 49.35 Favored 'General case' 0 C--N 1.342 0.268 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 -179.325 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 58.1 m170 -50.22 -39.82 45.58 Favored 'General case' 0 CA--C 1.529 0.166 0 O-C-N 123.266 0.353 . . . . 0.0 110.227 178.344 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 3.7 t -84.81 -53.97 9.65 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.167 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.032 -178.679 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 31.6 mm -55.22 -50.33 65.25 Favored 'Isoleucine or valine' 0 C--N 1.343 0.307 0 O-C-N 122.797 0.061 . . . . 0.0 110.918 -175.788 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 25.5 t30 -82.42 -3.2 55.21 Favored 'General case' 0 CA--C 1.533 0.305 0 N-CA-C 110.175 -0.306 . . . . 0.0 110.175 -178.498 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 52.8 mtmt 55.19 37.82 29.48 Favored 'General case' 0 C--N 1.347 0.466 0 N-CA-C 108.839 -0.801 . . . . 0.0 108.839 -178.294 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.9 -32.47 73.74 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 115.567 -0.742 . . . . 0.0 109.885 -178.877 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 15.6 ptp180 -157.48 145.05 18.69 Favored 'General case' 0 N--CA 1.452 -0.362 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 179.007 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 30.8 t80 -79.66 92.12 5.33 Favored 'General case' 0 N--CA 1.455 -0.214 0 N-CA-C 109.752 -0.462 . . . . 0.0 109.752 -178.812 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 11.7 m -72.75 163.58 3.88 Favored 'Isoleucine or valine' 0 C--O 1.233 0.22 0 N-CA-C 109.92 -0.4 . . . . 0.0 109.92 178.845 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -65.35 157.03 30.32 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 178.142 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -53.92 -38.02 64.42 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 122.575 0.35 . . . . 0.0 110.415 -179.946 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -68.14 -12.4 60.84 Favored 'General case' 0 CA--C 1.538 0.518 0 N-CA-C 112.172 0.434 . . . . 0.0 112.172 -177.432 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -94.67 -52.31 4.34 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 118.343 0.52 . . . . 0.0 109.9 179.546 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 6.6 ptm180 -69.45 -35.28 75.49 Favored 'General case' 0 CA--C 1.53 0.2 0 N-CA-C 112.02 0.378 . . . . 0.0 112.02 -176.645 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 43.2 p-10 -57.59 -38.62 75.2 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 118.202 0.456 . . . . 0.0 110.162 -179.214 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.41 -43.09 91.64 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 110.32 -0.252 . . . . 0.0 110.32 -179.86 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 87.4 t -60.51 -59.66 3.81 Favored 'Isoleucine or valine' 0 C--N 1.339 0.15 0 N-CA-C 110.105 -0.332 . . . . 0.0 110.105 -179.466 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 52.5 m95 -60.47 -37.28 80.52 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 116.718 -0.219 . . . . 0.0 110.942 -177.549 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -63.49 -58.2 7.77 Favored 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 178.895 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -52.39 -45.17 65.71 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 122.304 0.242 . . . . 0.0 110.766 -178.745 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 36.1 mt -54.7 -30.13 21.98 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 C-N-CA 122.245 0.218 . . . . 0.0 111.041 -179.437 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 7.7 mtpm? -85.11 -53.61 5.16 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 110.047 -0.353 . . . . 0.0 110.047 -178.676 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -63.98 -55.86 19.32 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.657 -175.425 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -73.87 -3.23 27.56 Favored 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 179.556 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 37.0 p-80 40.62 84.18 0.02 OUTLIER 'General case' 0 C--N 1.353 0.741 0 C-N-CA 124.036 0.934 . . . . 0.0 111.556 179.291 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 13.3 t80 -56.69 108.12 0.46 Allowed 'General case' 0 N--CA 1.456 -0.154 0 CA-C-N 115.527 -0.76 . . . . 0.0 109.166 178.963 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 30.5 t -165.65 85.13 1.01 Allowed Pre-proline 0 N--CA 1.451 -0.396 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 -179.028 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 3.5 Cg_exo -62.97 120.47 7.97 Favored 'Trans proline' 0 N--CA 1.447 -1.245 0 C-N-CA 122.639 2.226 . . . . 0.0 110.663 -179.906 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 11.5 p -74.42 -43.32 56.82 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 178.313 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -88.58 -171.01 3.16 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 178.782 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.427 ' O ' HG22 ' A' ' 50' ' ' VAL . 12.2 p 42.01 40.91 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.789 0 C-N-CA 123.524 0.73 . . . . 0.0 110.872 179.643 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -95.85 -55.44 2.99 Favored 'General case' 0 C--N 1.341 0.234 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 179.718 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 4.8 ppt_? -66.8 -27.85 67.9 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 116.587 -0.279 . . . . 0.0 110.436 179.698 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 49.5 m -78.84 130.6 35.87 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 109.341 -0.615 . . . . 0.0 109.341 179.538 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -74.22 88.74 2.0 Allowed 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 -179.647 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 30.4 tptt -148.69 124.63 10.63 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 179.643 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 27.7 m . . . . . 0 C--O 1.25 1.081 0 CA-C-O 116.317 -1.801 . . . . 0.0 108.714 178.348 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.5 tmm? . . . . . 0 N--CA 1.472 0.664 0 N-CA-C 110.034 -0.358 . . . . 0.0 110.034 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -67.26 96.69 0.49 Allowed 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 109.727 -0.472 . . . . 0.0 109.727 179.344 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 21.8 p -142.42 -77.89 0.25 Allowed 'General case' 0 N--CA 1.452 -0.353 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 -179.852 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 19.5 tt -140.44 -32.77 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.174 0 C-N-CA 123.009 0.524 . . . . 0.0 109.707 178.914 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 26.7 mmtp -67.35 -62.96 1.17 Allowed 'General case' 0 N--CA 1.445 -0.69 0 C-N-CA 122.785 0.434 . . . . 0.0 110.962 -179.425 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 65.7 m-20 -69.04 -42.83 75.82 Favored 'General case' 0 N--CA 1.461 0.105 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.798 -175.764 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.522 HG23 ' H ' ' A' ' 8' ' ' ALA . 18.7 m -53.31 -56.6 7.55 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.191 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 -179.905 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.522 ' H ' HG23 ' A' ' 7' ' ' VAL . . . -59.12 -45.88 89.78 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 122.988 0.515 . . . . 0.0 110.857 179.419 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 2.0 ttmp? -53.57 -49.74 67.05 Favored 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 110.178 -0.305 . . . . 0.0 110.178 -179.101 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 57.6 ttt85 -71.67 -37.81 70.72 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 122.371 0.268 . . . . 0.0 110.645 -179.007 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -60.53 -40.17 90.55 Favored 'General case' 0 N--CA 1.456 -0.168 0 C-N-CA 122.257 0.223 . . . . 0.0 110.793 -178.595 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 23.8 t-20 -140.79 -88.36 0.17 Allowed 'General case' 0 C--N 1.343 0.325 0 N-CA-C 110.461 -0.2 . . . . 0.0 110.461 -179.418 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 71.5 t -139.47 -57.35 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.345 0.38 0 N-CA-C 109.835 -0.432 . . . . 0.0 109.835 -178.266 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 67.1 m -152.44 176.34 11.77 Favored 'General case' 0 C--N 1.344 0.339 0 N-CA-C 109.872 -0.418 . . . . 0.0 109.872 -179.342 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 17.2 p -63.52 -20.59 65.74 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.103 -179.637 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 14.9 t -53.79 -38.82 64.89 Favored 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 109.999 -0.371 . . . . 0.0 109.999 179.601 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 18.0 m -61.47 -42.47 98.83 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 109.819 -0.438 . . . . 0.0 109.819 179.463 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 20.6 t -65.72 -35.63 75.65 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.14 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 179.356 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 23.1 t -65.28 -43.59 90.69 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 72.7 m-70 -64.16 -43.22 95.85 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.285 179.38 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 16.2 t -55.72 -47.17 79.58 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.28 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 179.123 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 60.3 mt -61.63 -48.46 88.66 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 29.4 m-80 -75.28 -9.97 59.04 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 122.167 0.187 . . . . 0.0 111.119 -179.245 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 4.8 tmtp? 62.38 42.97 8.51 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 122.893 0.477 . . . . 0.0 110.012 -179.881 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -98.24 -84.4 0.39 Allowed 'General case' 0 C--N 1.344 0.357 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 179.762 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 67.1 mtp180 -97.11 120.5 37.58 Favored 'General case' 0 N--CA 1.456 -0.126 0 N-CA-C 109.496 -0.557 . . . . 0.0 109.496 -179.792 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 29.2 p90 -149.77 120.78 7.7 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 179.234 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 3.8 t -81.76 75.97 0.96 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.396 0 N-CA-C 107.856 -1.164 . . . . 0.0 107.856 179.048 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 65.11 -178.89 0.18 Allowed 'General case' 0 C--O 1.236 0.348 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.094 -178.352 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 -65.29 -25.1 67.49 Favored 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 110.214 -0.291 . . . . 0.0 110.214 -179.197 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -52.09 -39.13 59.31 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 122.565 0.346 . . . . 0.0 110.813 179.438 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 99.0 m -59.07 -67.41 0.37 Allowed 'General case' 0 C--N 1.343 0.287 0 N-CA-C 110.439 -0.208 . . . . 0.0 110.439 -179.581 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 9.9 ptm180 -56.5 -39.13 72.77 Favored 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 110.581 -0.155 . . . . 0.0 110.581 -177.836 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -59.7 -57.39 13.12 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 110.305 -0.257 . . . . 0.0 110.305 -179.443 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -59.81 -42.25 93.06 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 122.429 0.292 . . . . 0.0 110.649 -179.102 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 21.3 t -58.39 -61.13 1.5 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.2 0 C-N-CA 122.365 0.266 . . . . 0.0 110.324 -179.216 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 19.5 m95 -61.63 -38.22 86.86 Favored 'General case' 0 N--CA 1.455 -0.177 0 N-CA-C 110.687 -0.116 . . . . 0.0 110.687 -178.145 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -59.65 -51.42 69.89 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 109.863 -0.421 . . . . 0.0 109.863 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -61.38 -46.94 88.1 Favored 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 122.29 0.236 . . . . 0.0 110.64 -179.38 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 55.5 mt -58.18 -41.83 81.82 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.295 0 C-N-CA 122.229 0.211 . . . . 0.0 110.496 -179.22 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 37.6 ttmt -74.2 -38.81 63.5 Favored 'General case' 0 N--CA 1.45 -0.449 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 -178.067 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -62.66 -52.83 61.78 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-N 116.564 -0.289 . . . . 0.0 110.455 -178.153 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 10.2 mp -79.24 -18.16 53.38 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-O 119.554 -0.26 . . . . 0.0 110.47 -179.061 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 22.2 m80 76.17 137.62 0.06 Allowed 'General case' 0 C--N 1.348 0.509 0 C-N-CA 123.871 0.868 . . . . 0.0 110.966 178.299 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 8.1 t80 -110.34 101.27 10.02 Favored 'General case' 0 CA--C 1.529 0.158 0 N-CA-C 108.466 -0.939 . . . . 0.0 108.466 178.729 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' SER . . . . . 0.439 ' CB ' ' HD3' ' A' ' 47' ' ' PRO . 1.1 m -60.22 -64.7 2.74 Favored Pre-proline 0 CA--C 1.544 0.724 0 CA-C-O 118.691 -0.671 . . . . 0.0 111.061 -177.587 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' PRO . . . . . 0.439 ' HD3' ' CB ' ' A' ' 46' ' ' SER . 8.6 Cg_exo -54.18 148.75 39.06 Favored 'Trans proline' 0 C--N 1.36 1.16 0 C-N-CA 121.856 1.704 . . . . 0.0 110.757 178.368 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 20.9 t -69.19 168.35 14.28 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 116.482 -0.327 . . . . 0.0 110.695 -178.819 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -60.33 -52.21 66.23 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-N 116.234 -0.439 . . . . 0.0 109.95 179.761 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 33.0 m -91.29 143.6 10.91 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.241 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 179.793 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -72.38 -48.19 43.57 Favored 'General case' 0 N--CA 1.455 -0.178 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 179.435 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 37.2 ttp85 -153.53 50.52 0.69 Allowed 'General case' 0 CA--C 1.531 0.218 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 179.688 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 27.2 m 49.88 47.42 23.17 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 122.68 0.392 . . . . 0.0 110.257 -179.796 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -66.46 -52.7 43.44 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 -179.571 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 56.8 mtpt 55.5 -121.22 1.68 Allowed 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 109.57 -0.53 . . . . 0.0 109.57 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 14.2 p . . . . . 0 C--O 1.251 1.149 0 CA-C-O 116.776 -1.583 . . . . 0.0 108.968 179.954 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.0 mpp? . . . . . 0 N--CA 1.479 1.021 0 N-CA-C 109.869 -0.419 . . . . 0.0 109.869 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -163.53 -79.12 0.03 OUTLIER 'General case' 0 C--N 1.345 0.37 0 CA-C-O 119.788 -0.149 . . . . 0.0 110.644 179.274 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 3.9 t 178.01 -42.52 0.01 OUTLIER 'General case' 0 C--N 1.349 0.545 0 C-N-CA 122.601 0.361 . . . . 0.0 110.244 -176.988 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 7.1 tt -146.34 -20.56 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.85 0 N-CA-C 111.836 0.31 . . . . 0.0 111.836 -177.956 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 15.6 tppt? -48.01 -70.26 0.1 Allowed 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 123.552 0.741 . . . . 0.0 112.293 -178.11 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 69.1 m-20 -63.07 -40.19 96.95 Favored 'General case' 0 C--O 1.221 -0.399 0 CA-C-O 119.787 -0.149 . . . . 0.0 110.711 -175.579 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.431 HG23 ' CD2' ' A' ' 45' ' ' TYR . 2.4 t -52.17 -46.35 43.86 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.175 0 C-N-CA 122.166 0.187 . . . . 0.0 110.785 -179.111 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -52.61 -61.36 2.33 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 110.584 -0.154 . . . . 0.0 110.584 -178.578 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -68.38 -28.21 66.91 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-O 119.791 -0.147 . . . . 0.0 111.347 -177.929 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 1.6 tpm_? -62.01 -48.0 82.23 Favored 'General case' 0 C--N 1.339 0.146 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 179.212 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -78.49 -1.07 32.01 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 110.068 -0.345 . . . . 0.0 110.068 178.033 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 58.6 t30 61.13 48.06 6.67 Favored 'General case' 0 C--N 1.348 0.501 0 C-N-CA 123.613 0.765 . . . . 0.0 110.828 178.8 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 30.3 m -146.43 148.01 17.45 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.221 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 177.671 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 69.2 m -63.91 154.76 32.85 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 109.762 -0.459 . . . . 0.0 109.762 179.604 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 15.0 t -53.81 -32.72 53.76 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 116.576 -0.283 . . . . 0.0 110.364 179.484 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 3.7 m -57.07 -43.0 81.66 Favored 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 178.891 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 6.1 m -63.06 -40.79 98.72 Favored 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 179.527 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 47.1 t -64.05 -39.05 84.07 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.238 0 N-CA-C 109.333 -0.618 . . . . 0.0 109.333 179.417 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 10.0 t -55.99 -37.64 69.38 Favored 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 110.129 -0.323 . . . . 0.0 110.129 179.337 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 43.0 m170 -61.27 -33.61 73.83 Favored 'General case' 0 C--N 1.341 0.237 0 N-CA-C 110.261 -0.274 . . . . 0.0 110.261 179.704 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 90.8 t -74.56 -41.41 48.8 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.099 0 C-N-CA 122.182 0.193 . . . . 0.0 110.886 -178.969 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 72.4 mt -49.23 -55.05 4.52 Favored 'Isoleucine or valine' 0 C--N 1.343 0.298 0 C-N-CA 122.297 0.239 . . . . 0.0 110.958 -176.828 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 5.8 p30 -104.8 13.31 31.51 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 117.558 0.163 . . . . 0.0 110.825 -178.36 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 65.1 mttt 46.9 58.57 4.63 Favored 'General case' 0 C--N 1.346 0.421 0 C-N-CA 122.829 0.452 . . . . 0.0 110.64 179.268 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -72.49 -65.98 0.72 Allowed 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 -179.528 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 84.1 mtt85 -94.04 129.06 40.7 Favored 'General case' 0 C--N 1.342 0.274 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 -179.608 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -77.14 111.12 12.41 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 109.37 -0.604 . . . . 0.0 109.37 179.942 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 9.5 m -110.03 43.31 0.27 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 CA-C-N 115.806 -0.633 . . . . 0.0 109.479 -178.881 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.416 ' C ' ' H ' ' A' ' 31' ' ' GLU . . . 54.79 22.69 4.34 Favored 'General case' 0 C--N 1.345 0.379 0 C-N-CA 123.565 0.746 . . . . 0.0 112.16 178.52 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 70.6 mm-40 65.82 -26.65 0.1 Allowed 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 124.052 0.941 . . . . 0.0 113.096 178.661 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.416 ' H ' ' C ' ' A' ' 29' ' ' ALA . 40.8 tt0 -48.11 -58.93 3.82 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 118.547 0.612 . . . . 0.0 110.879 -178.528 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 7.9 m -64.64 -39.63 94.03 Favored 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 110.744 -0.095 . . . . 0.0 110.744 -178.512 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 92.2 mtt180 -57.97 -52.89 63.63 Favored 'General case' 0 CA--C 1.533 0.299 0 N-CA-C 110.129 -0.323 . . . . 0.0 110.129 -179.327 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -63.72 -37.95 89.27 Favored 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 110.066 -0.346 . . . . 0.0 110.066 -179.232 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -60.63 -42.54 97.11 Favored 'General case' 0 C--N 1.341 0.205 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 179.051 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 20.6 t -65.59 -45.08 93.39 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 179.014 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 15.4 m95 -61.63 -33.75 74.47 Favored 'General case' 0 CA--C 1.531 0.244 0 N-CA-C 109.895 -0.409 . . . . 0.0 109.895 179.145 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -67.58 -42.96 81.7 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 109.033 -0.728 . . . . 0.0 109.033 177.365 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.64 -38.67 78.61 Favored 'General case' 0 C--N 1.345 0.393 0 N-CA-C 110.001 -0.37 . . . . 0.0 110.001 178.884 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -54.65 -44.88 71.65 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 179.367 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 15.0 mttm -94.99 12.55 28.05 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-O 119.655 -0.212 . . . . 0.0 111.313 -178.467 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -79.32 -48.86 13.36 Favored 'General case' 0 N--CA 1.456 -0.168 0 N-CA-C 108.647 -0.872 . . . . 0.0 108.647 178.917 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -92.99 -94.03 0.15 Allowed 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 178.709 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 99.7 m-70 -159.79 26.41 0.18 Allowed 'General case' 0 C--N 1.343 0.286 0 C-N-CA 123.232 0.613 . . . . 0.0 109.533 -178.322 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.431 ' CD2' HG23 ' A' ' 7' ' ' VAL . 2.5 m-85 -80.84 153.36 27.71 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.989 0.423 . . . . 0.0 110.036 -177.931 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 22.2 p -167.21 76.6 1.01 Allowed Pre-proline 0 CA--C 1.536 0.412 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 -179.711 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -58.1 -47.38 20.46 Favored 'Trans proline' 0 N--CA 1.45 -1.067 0 C-N-CA 122.639 2.226 . . . . 0.0 111.024 -178.397 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 18.6 m -80.17 53.75 1.81 Allowed 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 110.229 -0.285 . . . . 0.0 110.229 -179.595 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -167.93 -56.01 0.02 OUTLIER 'General case' 0 N--CA 1.456 -0.174 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 179.625 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 9.9 p -65.34 128.51 28.24 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.27 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 -179.548 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -169.24 -58.55 0.02 OUTLIER 'General case' 0 C--N 1.342 0.242 0 N-CA-C 109.36 -0.607 . . . . 0.0 109.36 -179.674 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 44.4 ttm-85 57.63 45.87 18.45 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 122.787 0.435 . . . . 0.0 110.077 -179.829 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 16.6 m -70.46 139.4 51.72 Favored 'General case' 0 C--O 1.237 0.42 0 N-CA-C 109.765 -0.457 . . . . 0.0 109.765 179.772 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 2.3 pp -63.8 157.55 24.17 Favored 'General case' 0 C--N 1.341 0.229 0 N-CA-C 109.934 -0.395 . . . . 0.0 109.934 179.534 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 47.2 mmtt -95.59 -43.06 8.11 Favored 'General case' 0 CA--C 1.528 0.113 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 -178.829 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 14.6 p . . . . . 0 C--O 1.255 1.355 0 CA-C-O 116.495 -1.716 . . . . 0.0 108.997 179.686 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.474 0.773 0 CA-C-O 120.879 0.371 . . . . 0.0 110.683 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -79.07 63.92 3.86 Favored 'General case' 0 C--N 1.342 0.277 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 179.578 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 5.2 m -126.46 50.03 1.96 Allowed 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 108.52 -0.918 . . . . 0.0 108.52 -178.975 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER 80.53 -23.88 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.465 0 C-N-CA 124.484 1.114 . . . . 0.0 110.429 -179.688 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -66.97 -66.03 0.61 Allowed 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 122.568 0.347 . . . . 0.0 110.252 -179.812 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 91.3 m-20 -65.55 -39.0 91.23 Favored 'General case' 0 C--O 1.227 -0.084 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 84.7 t -55.52 -44.25 75.57 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.235 0 C-N-CA 122.673 0.389 . . . . 0.0 110.176 -179.487 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -57.6 -47.07 83.16 Favored 'General case' 0 C--N 1.34 0.187 0 C-N-CA 122.044 0.137 . . . . 0.0 110.707 -179.294 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 6.3 mmmm -67.09 -41.12 86.84 Favored 'General case' 0 N--CA 1.457 -0.089 0 N-CA-C 109.773 -0.454 . . . . 0.0 109.773 179.912 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 45.0 ttt85 -59.52 -35.79 74.86 Favored 'General case' 0 N--CA 1.452 -0.351 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 179.131 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -75.89 -56.93 4.2 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 110.029 -0.359 . . . . 0.0 110.029 179.556 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -164.15 -93.73 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 119.82 -0.133 . . . . 0.0 111.276 -179.151 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 5.0 m -97.94 -118.63 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 C-N-CA 122.232 0.213 . . . . 0.0 110.867 -176.248 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 89.5 p -105.98 -175.09 2.7 Favored 'General case' 0 C--N 1.344 0.36 0 C-N-CA 122.621 0.368 . . . . 0.0 110.327 -176.981 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 76.8 p -55.83 -23.83 32.81 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.215 -178.398 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.4 HG23 ' N ' ' A' ' 17' ' ' THR . 13.2 t -51.62 -44.83 63.05 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 117.724 0.238 . . . . 0.0 110.426 -179.898 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' THR . . . . . 0.4 ' N ' HG23 ' A' ' 16' ' ' THR . 2.4 m -64.92 -47.91 76.04 Favored 'General case' 0 C--N 1.341 0.219 0 N-CA-C 110.301 -0.259 . . . . 0.0 110.301 -179.453 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 54.6 t -58.4 -44.84 89.52 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.169 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 -179.47 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 56.3 m -60.91 -45.81 93.18 Favored 'General case' 0 C--O 1.22 -0.496 0 N-CA-C 110.013 -0.365 . . . . 0.0 110.013 179.489 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 34.7 m170 -58.31 -41.58 84.78 Favored 'General case' 0 C--N 1.339 0.148 0 N-CA-C 110.292 -0.262 . . . . 0.0 110.292 -179.608 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 42.4 t -65.88 -55.93 17.17 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.257 0 O-C-N 123.085 0.241 . . . . 0.0 110.688 -178.939 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 92.6 mt -64.02 -53.34 45.12 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 N-CA-C 110.299 -0.26 . . . . 0.0 110.299 -177.69 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 19.4 t-20 -62.32 -30.66 71.31 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 122.624 0.37 . . . . 0.0 110.581 -179.237 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 41.2 tttp 71.45 53.09 0.23 Allowed 'General case' 0 C--N 1.344 0.342 0 C-N-CA 122.915 0.486 . . . . 0.0 109.735 179.816 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 26.6 p -75.71 -64.57 1.05 Allowed 'General case' 0 C--N 1.34 0.154 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 179.39 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 48.6 ttp85 -128.89 134.23 48.2 Favored 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 179.629 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 54.6 p90 -64.85 143.19 58.11 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 179.749 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 30.1 m -110.27 170.42 3.28 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.147 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 179.529 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -80.3 51.35 1.4 Allowed 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 122.402 0.281 . . . . 0.0 111.213 -177.728 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 63.79 -68.68 0.09 Allowed 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.249 1.02 . . . . 0.0 112.746 177.835 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 56.5 mm-40 -37.4 -53.5 1.12 Allowed 'General case' 0 C--N 1.34 0.162 0 C-N-CA 123.729 0.812 . . . . 0.0 112.076 -175.042 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 8.2 m -60.05 -52.04 67.07 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 116.983 -0.098 . . . . 0.0 111.015 -177.47 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 11.8 ttp85 -60.89 -47.47 86.24 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 122.26 0.224 . . . . 0.0 110.64 -178.58 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 20.5 m-80 -61.69 -41.18 97.22 Favored 'General case' 0 N--CA 1.456 -0.158 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 -179.788 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -60.79 -40.62 93.3 Favored 'General case' 0 C--N 1.34 0.185 0 N-CA-C 110.158 -0.312 . . . . 0.0 110.158 179.852 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 38.0 t -64.09 -53.79 39.39 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.199 0 N-CA-C 109.6 -0.518 . . . . 0.0 109.6 179.439 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 13.5 m95 -59.82 -33.92 72.39 Favored 'General case' 0 C--O 1.233 0.229 0 N-CA-C 110.615 -0.143 . . . . 0.0 110.615 -179.202 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -70.37 -57.85 4.38 Favored 'General case' 0 C--O 1.224 -0.286 0 N-CA-C 109.789 -0.449 . . . . 0.0 109.789 179.401 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -50.09 -44.19 51.81 Favored 'General case' 0 C--N 1.341 0.203 0 C-N-CA 122.94 0.496 . . . . 0.0 111.066 -179.082 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 13.8 mt -51.36 -40.92 24.62 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 C-N-CA 122.977 0.511 . . . . 0.0 111.046 -179.36 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 41.2 mttp -98.03 -20.0 17.66 Favored 'General case' 0 C--N 1.344 0.328 0 N-CA-C 111.567 0.21 . . . . 0.0 111.567 -177.13 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -73.17 -50.04 24.8 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 109.106 -0.702 . . . . 0.0 109.106 -178.089 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 51.6 tp -77.64 -92.0 0.03 OUTLIER 'General case' 0 N--CA 1.446 -0.642 0 N-CA-C 108.153 -1.054 . . . . 0.0 108.153 177.963 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 4.0 p-80 165.3 75.87 0.0 OUTLIER 'General case' 0 C--N 1.341 0.233 0 C-N-CA 123.759 0.824 . . . . 0.0 108.996 179.781 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 15.6 t80 -70.0 136.78 50.78 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.118 -0.492 . . . . 0.0 109.776 -179.411 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 19.9 p -117.96 96.59 49.81 Favored Pre-proline 0 CA--C 1.537 0.446 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 178.814 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 10.9 Cg_endo -71.96 72.78 2.6 Favored 'Trans proline' 0 N--CA 1.449 -1.092 0 C-N-CA 122.68 2.253 . . . . 0.0 110.184 179.031 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 19.5 m -60.01 -35.34 74.85 Favored 'General case' 0 CA--C 1.529 0.14 0 C-N-CA 122.442 0.297 . . . . 0.0 110.271 -179.827 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -57.02 -38.43 73.12 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 122.455 0.302 . . . . 0.0 110.405 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 11.2 t -128.77 65.56 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.342 0.262 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 -179.925 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -75.06 -63.85 1.18 Allowed 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 109.554 -0.536 . . . . 0.0 109.554 179.74 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 18.9 ttm180 -165.07 -141.27 0.05 OUTLIER 'General case' 0 N--CA 1.451 -0.379 0 N-CA-C 108.532 -0.914 . . . . 0.0 108.532 179.312 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 42.7 t -103.24 -52.05 3.11 Favored 'General case' 0 C--N 1.338 0.077 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 -179.897 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -94.65 -171.52 2.5 Favored 'General case' 0 CA--C 1.536 0.409 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 -179.722 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 4.4 ttpt -68.35 -38.5 81.53 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 122.417 0.287 . . . . 0.0 110.693 -178.398 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 33.0 t . . . . . 0 C--O 1.25 1.099 0 CA-C-O 117.292 -1.337 . . . . 0.0 109.98 -178.981 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.478 0.974 0 CA-C-O 119.693 -0.194 . . . . 0.0 111.4 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -53.57 -77.93 0.02 OUTLIER 'General case' 0 C--N 1.352 0.69 0 N-CA-C 110.203 -0.295 . . . . 0.0 110.203 -179.276 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 3.2 m 64.23 167.75 0.16 Allowed 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 122.667 0.387 . . . . 0.0 110.686 177.564 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER 77.75 -40.79 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.528 0 C-N-CA 124.228 1.011 . . . . 0.0 108.734 -177.856 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 62.9 mttp -69.68 -60.97 1.98 Allowed 'General case' 0 N--CA 1.446 -0.64 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 177.586 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -63.91 -51.49 64.25 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 115.683 -0.69 . . . . 0.0 109.502 178.619 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 76.5 t -45.65 -47.1 4.79 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.225 0 C-N-CA 123.121 0.569 . . . . 0.0 111.707 -177.399 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -53.86 -62.46 1.64 Allowed 'General case' 0 C--O 1.223 -0.313 0 CA-C-N 117.511 0.142 . . . . 0.0 111.333 -177.78 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 21.7 mmmt -68.45 -44.11 75.6 Favored 'General case' 0 C--N 1.331 -0.232 0 O-C-N 122.45 -0.156 . . . . 0.0 110.988 -176.874 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 16.3 tpp180 -57.82 -39.82 78.52 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 122.568 0.347 . . . . 0.0 110.7 -178.467 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -98.22 12.86 33.26 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-O 119.562 -0.256 . . . . 0.0 110.825 -179.384 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ASN . . . . . 0.912 ' O ' HG22 ' A' ' 13' ' ' VAL . 48.6 t30 75.52 150.83 0.12 Allowed 'General case' 0 C--N 1.35 0.589 0 C-N-CA 123.684 0.793 . . . . 0.0 110.147 179.945 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.912 HG22 ' O ' ' A' ' 12' ' ' ASN . 2.2 m 82.94 175.1 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.479 0.982 0 C-N-CA 125.679 1.591 . . . . 0.0 110.315 -179.609 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 22.4 t -96.91 -178.06 4.09 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.501 -177.623 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 19.1 p -69.0 -45.17 71.25 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.383 -179.048 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 11.9 t -56.22 -41.93 76.45 Favored 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 110.46 -0.2 . . . . 0.0 110.46 -179.121 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -65.3 -28.28 69.21 Favored 'General case' 0 CA--C 1.53 0.202 0 O-C-N 122.24 -0.287 . . . . 0.0 110.34 179.893 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 65.8 t -76.59 -37.89 30.21 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.199 0 N-CA-C 108.496 -0.927 . . . . 0.0 108.496 176.707 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 19.6 m -58.71 -33.08 69.79 Favored 'General case' 0 CA--C 1.531 0.226 0 N-CA-C 109.989 -0.374 . . . . 0.0 109.989 178.521 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 51.4 m170 -56.13 -39.35 72.1 Favored 'General case' 0 C--N 1.345 0.381 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 178.398 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 56.4 t -68.02 -46.36 81.87 Favored 'Isoleucine or valine' 0 C--N 1.341 0.211 0 N-CA-C 109.786 -0.45 . . . . 0.0 109.786 179.66 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 72.7 mt -58.87 -39.57 77.82 Favored 'Isoleucine or valine' 0 C--O 1.234 0.253 0 N-CA-C 109.835 -0.431 . . . . 0.0 109.835 -179.236 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 34.5 m-80 -93.77 15.35 16.67 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 122.369 0.267 . . . . 0.0 110.282 179.436 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 30.15 65.39 0.14 Allowed 'General case' 0 C--N 1.356 0.868 0 C-N-CA 124.376 1.07 . . . . 0.0 111.566 -179.357 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 17.4 p -104.44 -83.7 0.49 Allowed 'General case' 0 C--N 1.342 0.24 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 178.208 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 14.4 tpt180 -90.81 105.29 17.72 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 108.936 -0.764 . . . . 0.0 108.936 179.212 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 40.7 t80 -78.26 100.45 6.69 Favored 'General case' 0 N--CA 1.454 -0.227 0 N-CA-C 109.705 -0.48 . . . . 0.0 109.705 -179.738 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 4.3 t -87.28 57.4 0.17 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.42 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 -179.917 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 65.26 176.25 0.21 Allowed 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 123.233 0.613 . . . . 0.0 111.489 178.933 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 48.1 mp0 -68.9 -25.74 64.75 Favored 'General case' 0 C--O 1.219 -0.509 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.009 -179.273 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 20.6 tp10 -53.81 -60.26 3.55 Favored 'General case' 0 C--O 1.226 -0.165 0 C-N-CA 122.559 0.344 . . . . 0.0 111.263 -176.982 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 63.1 p -61.83 -44.75 96.21 Favored 'General case' 0 C--O 1.224 -0.272 0 N-CA-C 110.003 -0.369 . . . . 0.0 110.003 -178.555 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 64.7 ttp85 -56.37 -60.19 3.87 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 122.41 0.284 . . . . 0.0 111.284 -178.192 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -67.01 -39.91 87.17 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-O 119.603 -0.236 . . . . 0.0 111.08 -175.231 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -62.8 -45.13 94.06 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 117.881 0.309 . . . . 0.0 110.409 -179.777 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 20.3 t -60.63 -57.25 12.82 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.108 0 C-N-CA 122.299 0.24 . . . . 0.0 110.646 -178.802 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 14.9 m95 -60.14 -38.04 81.89 Favored 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 110.77 -0.085 . . . . 0.0 110.77 -178.151 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -63.25 -53.23 56.28 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 -179.933 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -60.3 -40.49 90.72 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-N 116.569 -0.287 . . . . 0.0 110.636 -179.139 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 14.3 mt -59.53 -44.53 93.27 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.146 0 N-CA-C 110.232 -0.284 . . . . 0.0 110.232 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 57.8 tptt -70.27 -35.28 73.65 Favored 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 -178.59 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -66.74 -52.87 39.27 Favored 'General case' 0 N--CA 1.443 -0.798 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.041 -177.98 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 10.5 mp -81.78 -21.05 38.0 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 122.348 0.259 . . . . 0.0 111.305 -177.456 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 2.4 m-70 71.73 110.66 0.06 Allowed 'General case' 0 N--CA 1.465 0.317 0 N-CA-C 108.636 -0.876 . . . . 0.0 108.636 -177.032 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -103.78 108.36 19.63 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 122.83 0.452 . . . . 0.0 110.387 -176.522 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 55.8 p -89.53 116.73 67.08 Favored Pre-proline 0 CA--C 1.536 0.425 0 N-CA-C 108.323 -0.992 . . . . 0.0 108.323 176.753 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -70.68 79.26 1.25 Allowed 'Trans proline' 0 N--CA 1.452 -0.917 0 C-N-CA 122.313 2.009 . . . . 0.0 110.903 -178.434 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 23.3 t 48.14 45.86 19.65 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 122.813 0.445 . . . . 0.0 110.69 178.873 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -154.0 95.21 1.83 Allowed 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 109.743 -0.466 . . . . 0.0 109.743 -179.43 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 33.9 m -69.04 152.46 9.48 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.231 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 179.466 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -153.0 84.73 1.21 Allowed 'General case' 0 N--CA 1.453 -0.317 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 -179.777 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 42.9 ttt85 57.98 42.75 22.28 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 -179.357 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 27.8 p -79.26 71.26 5.78 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 179.658 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 72.2 mt -75.33 77.84 2.42 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 -179.739 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 47.0 mtmt 63.35 46.2 4.54 Favored 'General case' 0 C--N 1.342 0.267 0 C-N-CA 123.154 0.582 . . . . 0.0 109.949 -179.622 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 76.6 t . . . . . 0 C--O 1.248 0.984 0 CA-C-O 116.833 -1.556 . . . . 0.0 108.645 179.03 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 18.7 mmt . . . . . 0 N--CA 1.473 0.683 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -165.15 -171.94 2.37 Favored 'General case' 0 C--N 1.341 0.203 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 -179.592 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -135.01 -53.08 0.79 Allowed 'General case' 0 C--O 1.223 -0.336 0 N-CA-C 109.712 -0.477 . . . . 0.0 109.712 179.669 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 14.8 tt -177.19 -35.52 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.344 0.33 0 O-C-N 123.667 0.605 . . . . 0.0 109.802 -178.974 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 22.3 mtmm -48.33 -68.55 0.17 Allowed 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 123.657 0.783 . . . . 0.0 111.849 -177.587 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -52.23 -58.46 6.57 Favored 'General case' 0 C--O 1.219 -0.504 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.073 -177.667 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 63.1 t -50.22 -42.4 20.17 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.398 0 O-C-N 123.001 0.188 . . . . 0.0 111.197 -176.434 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -53.38 -62.86 1.38 Allowed 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 112.019 0.377 . . . . 0.0 112.019 -177.024 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 19.0 mtpp -79.1 -38.33 36.47 Favored 'General case' 0 N--CA 1.461 0.12 0 N-CA-C 110.618 -0.142 . . . . 0.0 110.618 -176.088 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 57.5 ttm-85 -57.6 -35.26 70.2 Favored 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 179.197 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -76.36 -60.82 2.17 Favored 'General case' 0 C--N 1.347 0.463 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 177.288 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 179.99 131.0 0.1 Allowed 'General case' 0 C--N 1.347 0.461 0 CA-C-O 120.686 0.279 . . . . 0.0 111.295 179.641 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 37.8 t 52.18 -94.52 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 C-N-CA 123.788 0.835 . . . . 0.0 111.497 176.31 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 66.9 m -149.96 -178.31 6.41 Favored 'General case' 0 C--N 1.344 0.364 0 CA-C-O 120.777 0.322 . . . . 0.0 110.368 -177.479 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 10.0 m -53.2 -35.26 59.68 Favored 'General case' 0 C--O 1.224 -0.259 0 C-N-CA 123.161 0.585 . . . . 0.0 110.975 -178.803 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 17.1 p -51.71 -46.86 64.1 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 122.46 0.304 . . . . 0.0 110.425 -179.29 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 24.9 m -65.62 -48.42 72.3 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 110.327 -0.249 . . . . 0.0 110.327 -178.907 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 87.5 t -60.38 -35.1 60.46 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.35 0 N-CA-C 110.242 -0.281 . . . . 0.0 110.242 -179.439 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 7.7 t -59.48 -45.06 92.72 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 109.983 -0.377 . . . . 0.0 109.983 -179.609 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 80.6 m-70 -58.49 -40.11 81.87 Favored 'General case' 0 N--CA 1.456 -0.135 0 O-C-N 122.996 0.185 . . . . 0.0 110.695 -179.021 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 52.9 t -56.27 -52.7 48.44 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.153 0 N-CA-C 110.003 -0.369 . . . . 0.0 110.003 -179.599 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 78.4 mt -66.04 -42.5 91.7 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 -179.415 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 37.8 t-20 -66.02 -20.92 66.34 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 122.973 0.509 . . . . 0.0 110.608 -179.545 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 74.3 tttt 66.24 50.98 1.29 Allowed 'General case' 0 C--N 1.343 0.289 0 C-N-CA 122.952 0.501 . . . . 0.0 109.655 -179.607 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -97.95 -82.89 0.41 Allowed 'General case' 0 C--N 1.341 0.212 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 179.665 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 19.0 ptp180 -87.36 154.17 20.89 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 179.792 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 50.5 t80 -123.83 145.39 49.11 Favored 'General case' 0 N--CA 1.456 -0.151 0 N-CA-C 109.886 -0.413 . . . . 0.0 109.886 -179.729 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.481 HG12 ' H ' ' A' ' 29' ' ' ALA . 2.9 t -134.97 172.87 15.35 Favored 'Isoleucine or valine' 0 C--O 1.231 0.114 0 N-CA-C 107.828 -1.175 . . . . 0.0 107.828 179.198 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.481 ' H ' HG12 ' A' ' 28' ' ' VAL . . . -48.08 149.52 1.41 Allowed 'General case' 0 C--O 1.235 0.331 0 N-CA-C 110.142 -0.318 . . . . 0.0 110.142 179.051 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 22.2 mp0 -51.3 -28.37 11.89 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.681 -179.225 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -57.02 -47.91 79.74 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 122.216 0.206 . . . . 0.0 110.499 179.624 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 10.4 m -64.82 -49.7 69.58 Favored 'General case' 0 C--N 1.344 0.359 0 N-CA-C 110.189 -0.3 . . . . 0.0 110.189 -178.74 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 38.4 mmt-85 -55.84 -50.64 70.0 Favored 'General case' 0 N--CA 1.455 -0.206 0 N-CA-C 109.785 -0.45 . . . . 0.0 109.785 -179.557 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -59.0 -48.49 81.38 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 122.552 0.341 . . . . 0.0 110.379 -179.613 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -57.83 -45.2 86.53 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 122.121 0.168 . . . . 0.0 110.678 -178.934 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 54.6 t -60.28 -57.24 12.73 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 N-CA-C 110.243 -0.28 . . . . 0.0 110.243 -178.985 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 41.4 m95 -60.63 -40.26 91.25 Favored 'General case' 0 CA--C 1.53 0.183 0 N-CA-C 110.735 -0.098 . . . . 0.0 110.735 -178.434 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -60.29 -53.14 61.24 Favored 'General case' 0 N--CA 1.453 -0.278 0 N-CA-C 109.722 -0.473 . . . . 0.0 109.722 179.69 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -56.41 -45.19 80.79 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 122.316 0.246 . . . . 0.0 110.493 -179.632 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 31.1 mt -56.18 -36.9 47.34 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.472 0 C-N-CA 122.256 0.223 . . . . 0.0 110.694 -179.314 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 6.3 mptp? -80.23 -45.6 17.71 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 -178.587 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 24.1 mm-40 -58.29 -47.4 83.78 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 122.48 0.312 . . . . 0.0 110.964 -178.052 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 6.0 mp -80.67 -1.8 44.01 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-O 119.611 -0.233 . . . . 0.0 110.777 -178.691 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 4.7 m-70 60.05 32.0 20.84 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 122.873 0.469 . . . . 0.0 110.905 178.454 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 10.2 t80 -61.79 135.26 57.52 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.438 -0.579 . . . . 0.0 109.438 179.237 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 40.3 t -159.39 118.78 1.69 Allowed Pre-proline 0 CA--C 1.533 0.294 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 -179.893 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 15.5 Cg_endo -72.93 71.17 3.48 Favored 'Trans proline' 0 N--CA 1.45 -1.03 0 C-N-CA 122.751 2.301 . . . . 0.0 109.864 179.219 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 10.6 p -80.18 -57.19 3.73 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 -179.226 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -81.26 51.17 1.56 Allowed 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 110.252 -0.277 . . . . 0.0 110.252 -179.81 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.54 ' O ' HG13 ' A' ' 50' ' ' VAL . 11.8 p -73.76 95.74 0.8 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.417 0 N-CA-C 109.754 -0.462 . . . . 0.0 109.754 -179.529 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 57.17 42.18 25.96 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.624 179.953 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 15.4 ptm180 -158.21 38.25 0.25 Allowed 'General case' 0 CA--C 1.532 0.288 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 179.021 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 14.7 m -63.83 118.32 8.19 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 -179.724 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 69.6 tp -65.47 121.93 16.02 Favored 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -139.63 -51.71 0.52 Allowed 'General case' 0 C--N 1.34 0.177 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 179.655 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 58.1 t . . . . . 0 C--O 1.252 1.211 0 CA-C-O 116.706 -1.616 . . . . 0.0 108.707 179.654 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.3 ptt? . . . . . 0 N--CA 1.472 0.651 0 N-CA-C 110.133 -0.321 . . . . 0.0 110.133 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 60.43 -173.91 0.12 Allowed 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 123.047 0.539 . . . . 0.0 110.651 -179.978 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' THR . . . . . 0.734 HG22 ' H ' ' A' ' 4' ' ' ILE . 2.1 m 84.51 -176.75 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 124.2 1.0 . . . . 0.0 109.326 177.272 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.734 ' H ' HG22 ' A' ' 3' ' ' THR . 19.8 tt -49.06 -29.17 2.93 Favored 'Isoleucine or valine' 0 C--N 1.342 0.254 0 C-N-CA 122.525 0.33 . . . . 0.0 110.149 179.507 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 45.0 mtpt -57.01 -60.14 4.03 Favored 'General case' 0 N--CA 1.446 -0.625 0 C-N-CA 122.699 0.399 . . . . 0.0 110.475 179.059 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -70.19 -42.64 72.12 Favored 'General case' 0 N--CA 1.458 -0.068 0 N-CA-C 110.168 -0.308 . . . . 0.0 110.168 -177.683 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 54.8 t -55.01 -47.74 76.58 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.166 0 N-CA-C 110.188 -0.301 . . . . 0.0 110.188 -179.408 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -58.16 -54.98 40.86 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 122.349 0.26 . . . . 0.0 110.864 -178.455 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 27.0 tttt -65.79 -27.39 68.24 Favored 'General case' 0 CA--C 1.531 0.247 0 O-C-N 122.808 0.068 . . . . 0.0 110.908 -177.931 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.95 -36.22 69.82 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 177.759 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -78.19 -41.59 34.1 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.264 -178.427 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -155.12 -147.67 0.21 Allowed 'General case' 0 N--CA 1.449 -0.504 0 CA-C-O 120.841 0.353 . . . . 0.0 110.727 -177.321 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 62.0 t -71.44 -54.39 17.43 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.501 0 C-N-CA 123.012 0.525 . . . . 0.0 110.336 -178.804 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 50.8 m -155.49 -179.05 7.73 Favored 'General case' 0 C--N 1.346 0.42 0 CA-C-O 121.007 0.432 . . . . 0.0 110.806 -177.806 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.8 m -66.98 -3.26 6.67 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.158 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 16.6 p -57.83 -56.09 26.48 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 179.132 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -60.29 -33.86 72.95 Favored 'General case' 0 CA--C 1.537 0.442 0 N-CA-C 110.265 -0.272 . . . . 0.0 110.265 -179.268 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 58.1 t -64.51 -46.74 91.82 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.222 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 179.269 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 20.6 m -60.26 -43.28 96.28 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 178.753 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 48.5 m170 -58.19 -43.3 87.48 Favored 'General case' 0 C--O 1.221 -0.414 0 N-CA-C 109.867 -0.419 . . . . 0.0 109.867 179.357 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 7.3 t -68.2 -39.61 81.46 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 C-N-CA 122.351 0.26 . . . . 0.0 111.155 -179.045 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 40.3 mt -60.04 -59.14 4.48 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.395 0 CA-C-O 119.424 -0.322 . . . . 0.0 111.789 -176.521 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 11.2 p30 -114.14 22.12 14.13 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-N 118.235 0.47 . . . . 0.0 112.1 -175.644 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 29.6 ttpt 55.22 46.04 24.58 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 122.313 0.245 . . . . 0.0 110.774 177.96 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -66.93 -35.33 79.75 Favored 'General case' 0 C--N 1.341 0.203 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 179.088 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 9.7 tpt180 -142.08 143.08 32.9 Favored 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 -179.89 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 63.8 t80 -68.03 137.11 54.8 Favored 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 -179.903 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 10.5 m -141.49 153.76 19.81 Favored 'Isoleucine or valine' 0 C--O 1.236 0.375 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 178.592 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -66.11 159.43 26.18 Favored 'General case' 0 N--CA 1.45 -0.438 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 179.273 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -52.18 -41.82 62.96 Favored 'General case' 0 CA--C 1.529 0.135 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 179.641 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 51.2 mt-10 -52.19 -47.37 65.59 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 123.039 0.536 . . . . 0.0 111.075 -179.165 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -61.05 -46.96 88.57 Favored 'General case' 0 C--N 1.341 0.208 0 N-CA-C 110.104 -0.332 . . . . 0.0 110.104 -178.704 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 27.6 ttm105 -58.43 -53.68 55.62 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.338 -178.875 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 29.2 m120 -60.68 -46.1 91.62 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 116.676 -0.238 . . . . 0.0 110.54 -179.275 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -56.63 -47.92 78.66 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 122.428 0.291 . . . . 0.0 110.782 -178.555 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 24.5 t -58.92 -56.64 15.55 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.196 0 N-CA-C 110.319 -0.252 . . . . 0.0 110.319 -179.108 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 20.6 m95 -59.91 -36.39 76.89 Favored 'General case' 0 C--N 1.341 0.201 0 O-C-N 122.568 -0.083 . . . . 0.0 110.888 -178.537 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -65.42 -51.65 58.8 Favored 'General case' 0 N--CA 1.456 -0.172 0 N-CA-C 110.051 -0.352 . . . . 0.0 110.051 179.894 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -57.51 -43.13 83.97 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 122.615 0.366 . . . . 0.0 110.776 -179.026 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 33.0 mt -56.85 -42.67 78.53 Favored 'Isoleucine or valine' 0 C--N 1.34 0.196 0 C-N-CA 122.205 0.202 . . . . 0.0 110.496 -179.447 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 37.0 mtmm -76.82 -36.49 56.87 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 110.024 -0.361 . . . . 0.0 110.024 -179.168 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -60.89 -60.95 2.98 Favored 'General case' 0 N--CA 1.451 -0.402 0 O-C-N 123.259 0.35 . . . . 0.0 110.924 -178.27 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -81.09 -18.69 45.68 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-O 119.624 -0.227 . . . . 0.0 111.268 -177.5 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 5.1 m-70 76.18 128.48 0.04 OUTLIER 'General case' 0 C--N 1.344 0.346 0 C-N-CA 123.411 0.685 . . . . 0.0 109.701 -178.567 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 6.7 t80 -81.97 74.11 8.97 Favored 'General case' 0 C--O 1.218 -0.592 0 N-CA-C 108.404 -0.961 . . . . 0.0 108.404 178.168 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' SER . . . . . 0.515 ' CB ' ' CD ' ' A' ' 47' ' ' PRO . 9.6 m 8.38 -81.04 0.0 OUTLIER Pre-proline 0 CA--C 1.556 1.211 0 C-N-CA 125.34 1.456 . . . . 0.0 113.876 -178.326 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' PRO . . . . . 0.515 ' CD ' ' CB ' ' A' ' 46' ' ' SER . 6.2 Cg_endo -58.49 -60.02 0.42 Allowed 'Trans proline' 0 C--N 1.366 1.491 0 C-N-CA 121.847 1.698 . . . . 0.0 111.545 -179.044 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 50.8 m 63.28 175.97 0.16 Allowed 'General case' 0 C--N 1.345 0.408 0 C-N-CA 123.308 0.643 . . . . 0.0 110.512 -178.846 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -66.46 -36.66 83.33 Favored 'General case' 0 N--CA 1.455 -0.189 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 178.513 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 14.7 p -154.4 149.72 12.41 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.412 0 N-CA-C 108.696 -0.853 . . . . 0.0 108.696 179.138 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -148.68 -142.78 0.13 Allowed 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 109.009 -0.737 . . . . 0.0 109.009 -179.824 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 32.6 ptt-85 -165.46 -46.53 0.03 OUTLIER 'General case' 0 CA--C 1.529 0.173 0 N-CA-C 109.759 -0.46 . . . . 0.0 109.759 -179.826 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 12.3 p -174.01 -68.38 0.01 OUTLIER 'General case' 0 N--CA 1.455 -0.211 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 -179.902 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 64.19 -175.98 0.16 Allowed 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 122.885 0.474 . . . . 0.0 109.784 -179.476 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -162.74 162.5 26.76 Favored 'General case' 0 N--CA 1.456 -0.155 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 -179.667 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 58.0 t . . . . . 0 C--O 1.252 1.199 0 CA-C-O 116.133 -1.889 . . . . 0.0 108.914 178.885 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 51.3 ttp . . . . . 0 N--CA 1.471 0.614 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -70.72 176.36 4.26 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 110.069 -0.345 . . . . 0.0 110.069 -179.918 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.3 m -158.69 -46.92 0.06 Allowed 'General case' 0 C--O 1.224 -0.259 0 N-CA-C 109.861 -0.422 . . . . 0.0 109.861 -178.848 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.47 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 11.4 tt 159.07 -37.03 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 C-N-CA 125.173 1.389 . . . . 0.0 108.26 -179.323 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 67.0 mttm -61.11 -62.71 1.65 Allowed 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 123.428 0.691 . . . . 0.0 110.956 -178.114 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -51.94 -48.45 64.27 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.315 -178.98 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 10.9 t -65.01 -38.63 83.29 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.363 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.73 -177.705 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.25 -38.76 90.5 Favored 'General case' 0 CA--C 1.531 0.213 0 N-CA-C 110.414 -0.217 . . . . 0.0 110.414 -179.627 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 64.8 mmtt -73.47 -35.52 65.72 Favored 'General case' 0 CA--C 1.53 0.19 0 N-CA-C 110.121 -0.326 . . . . 0.0 110.121 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.59 -40.41 80.48 Favored 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 178.145 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -70.54 -48.55 54.9 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 123.024 0.53 . . . . 0.0 111.096 -178.585 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 4.6 t-20 -156.28 -137.16 0.06 Allowed 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 110.494 -0.187 . . . . 0.0 110.494 -178.017 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 87.4 t -92.5 -43.01 13.68 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.141 0 C-N-CA 122.873 0.469 . . . . 0.0 110.38 -177.668 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 27.0 t -152.46 167.44 28.75 Favored 'General case' 0 N--CA 1.453 -0.325 0 N-CA-C 110.068 -0.345 . . . . 0.0 110.068 -178.83 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 14.8 t -60.84 -27.75 68.31 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.201 -179.877 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 6.3 m -53.3 -54.14 40.71 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 122.555 0.342 . . . . 0.0 110.223 179.936 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 7.2 m -61.21 -45.45 94.51 Favored 'General case' 0 C--N 1.34 0.177 0 N-CA-C 110.25 -0.278 . . . . 0.0 110.25 -179.321 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 93.4 t -59.4 -38.1 73.18 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.231 0 N-CA-C 109.884 -0.413 . . . . 0.0 109.884 -179.7 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 21.0 t -65.87 -48.31 72.0 Favored 'General case' 0 N--CA 1.449 -0.495 0 N-CA-C 109.314 -0.625 . . . . 0.0 109.314 -179.611 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 59.4 m-70 -52.84 -47.27 67.84 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 110.572 -0.158 . . . . 0.0 110.572 -179.439 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 47.2 t -53.18 -49.95 48.82 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 N-CA-C 109.797 -0.446 . . . . 0.0 109.797 179.767 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 58.1 mt -64.63 -39.07 84.36 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 N-CA-C 110.1 -0.333 . . . . 0.0 110.1 -179.62 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 13.2 m120 -77.51 -4.99 48.44 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 122.22 0.208 . . . . 0.0 110.869 -179.476 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 93.4 mttt 57.33 49.95 12.32 Favored 'General case' 0 C--N 1.344 0.365 0 C-N-CA 122.917 0.487 . . . . 0.0 110.071 -179.701 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 1.1 p -109.63 -79.98 0.58 Allowed 'General case' 0 C--N 1.343 0.285 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 179.752 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 51.2 ttm-85 -72.1 96.6 1.79 Allowed 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 109.168 -0.678 . . . . 0.0 109.168 179.843 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 32.7 t80 -74.91 98.32 3.53 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 109.866 -0.42 . . . . 0.0 109.866 -179.157 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -85.15 177.55 0.59 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.373 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 178.712 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.5 159.38 29.78 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 178.326 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -57.25 -35.37 69.64 Favored 'General case' 0 N--CA 1.455 -0.214 0 N-CA-C 109.935 -0.394 . . . . 0.0 109.935 179.676 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 51.6 mt-10 -58.89 -51.57 69.46 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 122.355 0.262 . . . . 0.0 110.324 179.876 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.56 -43.02 81.66 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 110.067 -0.346 . . . . 0.0 110.067 -178.748 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 29.7 ttm105 -56.42 -51.25 69.07 Favored 'General case' 0 N--CA 1.454 -0.271 0 N-CA-C 110.055 -0.35 . . . . 0.0 110.055 179.902 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 88.7 m-20 -63.11 -45.3 92.66 Favored 'General case' 0 N--CA 1.456 -0.161 0 N-CA-C 110.09 -0.337 . . . . 0.0 110.09 -179.88 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -56.88 -41.87 78.81 Favored 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 110.509 -0.182 . . . . 0.0 110.509 -179.612 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 36.8 t -64.07 -54.58 29.71 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 N-CA-C 109.947 -0.39 . . . . 0.0 109.947 -179.676 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 29.6 m95 -56.91 -39.89 75.26 Favored 'General case' 0 C--N 1.34 0.19 0 N-CA-C 110.466 -0.198 . . . . 0.0 110.466 -179.316 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -65.03 -56.71 11.52 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 179.622 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -50.09 -45.15 52.41 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 123.062 0.545 . . . . 0.0 111.33 -179.001 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 26.0 mt -53.29 -44.2 53.01 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.233 0 C-N-CA 122.297 0.239 . . . . 0.0 110.703 -178.882 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 39.1 ttpt -81.05 -37.35 29.19 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 122.068 0.147 . . . . 0.0 110.61 -177.557 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 70.0 mt-10 -52.19 -58.33 6.93 Favored 'General case' 0 C--N 1.342 0.259 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 -179.083 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -75.92 -46.67 28.77 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 -179.665 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 69.43 130.98 0.03 OUTLIER 'General case' 0 C--N 1.347 0.48 0 C-N-CA 123.22 0.608 . . . . 0.0 109.718 -178.988 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.47 ' CE2' ' HA ' ' A' ' 4' ' ' ILE . 5.1 p90 -156.77 -139.1 0.07 Allowed 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 179.398 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 5.5 t -45.49 -45.81 33.58 Favored Pre-proline 0 CA--C 1.549 0.913 0 N-CA-C 113.505 0.928 . . . . 0.0 113.505 -177.195 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 4.0 Cg_exo -61.95 131.57 35.59 Favored 'Trans proline' 0 C--N 1.36 1.165 0 C-N-CA 121.375 1.383 . . . . 0.0 110.633 -178.95 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 10.9 m 63.62 23.44 13.56 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 123.155 0.582 . . . . 0.0 111.231 179.641 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -79.95 -17.91 51.79 Favored 'General case' 0 C--N 1.342 0.258 0 N-CA-C 110.119 -0.326 . . . . 0.0 110.119 178.499 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 22.0 t -74.61 78.04 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.286 0 N-CA-C 109.449 -0.575 . . . . 0.0 109.449 -179.578 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -159.52 -141.19 0.08 Allowed 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 108.577 -0.897 . . . . 0.0 108.577 179.556 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 51.8 mmm-85 -123.14 -63.69 1.23 Allowed 'General case' 0 C--N 1.339 0.113 0 N-CA-C 108.991 -0.744 . . . . 0.0 108.991 179.354 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 27.7 t -169.97 -63.14 0.02 OUTLIER 'General case' 0 N--CA 1.457 -0.121 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 179.574 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 60.26 33.33 20.96 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 -179.116 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 25.9 tptp -158.36 144.31 17.0 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 -179.787 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 27.6 m . . . . . 0 C--O 1.248 0.993 0 CA-C-O 116.955 -1.498 . . . . 0.0 109.144 179.044 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.475 0.801 0 CA-C-O 120.721 0.296 . . . . 0.0 110.318 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -161.71 -73.34 0.06 Allowed 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 109.195 -0.668 . . . . 0.0 109.195 -179.487 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' THR . . . . . 0.411 ' C ' ' H ' ' A' ' 5' ' ' LYS . 1.6 p 65.64 131.94 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 124.396 1.078 . . . . 0.0 111.311 178.136 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER 74.58 -35.32 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 C-N-CA 124.348 1.059 . . . . 0.0 110.253 179.026 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.411 ' H ' ' C ' ' A' ' 3' ' ' THR . 96.5 mttt -70.78 -59.36 2.85 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 123.075 0.55 . . . . 0.0 110.39 -178.552 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -45.37 -58.56 3.23 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.721 0.808 . . . . 0.0 111.314 -178.422 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 88.3 t -61.44 -47.1 94.99 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.151 0 C-N-CA 122.57 0.348 . . . . 0.0 110.794 -177.15 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -56.74 -44.47 81.73 Favored 'General case' 0 N--CA 1.455 -0.205 0 O-C-N 122.24 -0.288 . . . . 0.0 110.299 -179.548 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.429 ' C ' ' H ' ' A' ' 12' ' ' ASN . 53.0 mttp -72.4 -15.61 61.84 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-O 119.187 -0.435 . . . . 0.0 111.441 -177.887 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 8.6 tpm_? -59.3 -43.87 92.57 Favored 'General case' 0 C--N 1.343 0.297 0 N-CA-C 108.034 -1.098 . . . . 0.0 108.034 177.091 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -99.15 7.08 46.15 Favored 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 176.298 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ASN . . . . . 0.429 ' H ' ' C ' ' A' ' 9' ' ' LYS . 47.5 t30 70.74 -84.9 0.03 OUTLIER 'General case' 0 C--N 1.347 0.497 0 C-N-CA 124.519 1.127 . . . . 0.0 110.163 -179.442 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 2.7 t 29.44 -125.2 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.74 0 C-N-CA 124.518 1.127 . . . . 0.0 110.564 -177.845 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.413 ' C ' ' H ' ' A' ' 16' ' ' THR . 1.5 m -175.25 84.52 0.03 OUTLIER 'General case' 0 C--N 1.347 0.487 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 179.084 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.4 p 50.7 -2.5 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 125.252 1.421 . . . . 0.0 114.697 177.591 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.413 ' H ' ' C ' ' A' ' 14' ' ' SER . 0.8 OUTLIER -88.68 -42.47 11.96 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 118.54 0.609 . . . . 0.0 110.669 -177.947 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 13.2 t -51.41 -42.25 61.33 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 122.334 0.253 . . . . 0.0 111.361 -177.908 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 42.4 t -60.12 -54.82 29.5 Favored 'Isoleucine or valine' 0 C--O 1.232 0.134 0 N-CA-C 109.93 -0.396 . . . . 0.0 109.93 -179.076 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 19.7 m -60.0 -42.02 93.38 Favored 'General case' 0 C--O 1.222 -0.361 0 CA-C-N 116.67 -0.241 . . . . 0.0 110.613 -179.496 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 24.3 m170 -62.58 -43.92 97.61 Favored 'General case' 0 CA--C 1.528 0.123 0 C-N-CA 122.202 0.201 . . . . 0.0 110.579 -178.455 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 9.3 t -64.56 -49.61 79.74 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.187 0 C-N-CA 122.249 0.22 . . . . 0.0 110.613 -178.616 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 89.1 mt -65.9 -51.5 60.38 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.23 0 N-CA-C 110.044 -0.354 . . . . 0.0 110.044 -178.669 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 20.4 t-20 -63.88 -31.47 72.67 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 122.649 0.38 . . . . 0.0 111.016 -178.693 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 17.7 ttmt 67.13 40.34 2.88 Favored 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 -177.822 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 12.5 t -74.68 -29.48 61.24 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.331 -179.015 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 2.0 tmt_? -157.96 125.02 5.01 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 -179.423 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 46.4 p90 -59.08 147.87 33.24 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 110.026 -0.361 . . . . 0.0 110.026 -179.878 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -106.66 -173.05 0.42 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.327 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 -179.877 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -79.18 40.93 0.43 Allowed 'General case' 0 CA--C 1.536 0.44 0 O-C-N 122.353 -0.217 . . . . 0.0 111.493 -178.06 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 63.95 -74.58 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 123.347 0.659 . . . . 0.0 111.607 178.238 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -58.88 -35.06 72.38 Favored 'General case' 0 C--N 1.341 0.207 0 C-N-CA 122.5 0.32 . . . . 0.0 110.776 -177.946 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 8.9 m -61.06 -40.65 94.47 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 179.205 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 19.5 ttt180 -71.03 -43.03 68.7 Favored 'General case' 0 N--CA 1.454 -0.235 0 N-CA-C 109.689 -0.486 . . . . 0.0 109.689 179.383 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 35.0 t30 -58.07 -45.02 87.81 Favored 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 109.857 -0.423 . . . . 0.0 109.857 179.217 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -58.26 -42.58 86.77 Favored 'General case' 0 N--CA 1.456 -0.174 0 C-N-CA 122.541 0.337 . . . . 0.0 110.667 -179.505 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 25.6 t -62.67 -53.52 45.95 Favored 'Isoleucine or valine' 0 C--O 1.233 0.225 0 N-CA-C 109.924 -0.398 . . . . 0.0 109.924 -179.737 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 38.8 m95 -59.11 -39.97 83.94 Favored 'General case' 0 C--N 1.339 0.144 0 N-CA-C 110.487 -0.19 . . . . 0.0 110.487 -179.828 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -63.76 -52.32 60.94 Favored 'General case' 0 C--O 1.222 -0.369 0 N-CA-C 110.175 -0.306 . . . . 0.0 110.175 -179.459 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -56.07 -39.77 72.57 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 122.386 0.274 . . . . 0.0 111.334 -178.378 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 19.8 mt -53.34 -56.56 7.75 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 C-N-CA 122.219 0.208 . . . . 0.0 111.399 -177.617 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.3 -26.56 24.86 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 117.688 0.222 . . . . 0.0 111.473 -176.536 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -71.23 -47.71 55.65 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 117.875 0.307 . . . . 0.0 110.544 -178.195 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 79.1 mt -80.08 -14.59 58.4 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-O 119.389 -0.339 . . . . 0.0 110.939 -178.38 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 88.0 m-70 53.35 45.5 28.29 Favored 'General case' 0 C--N 1.348 0.514 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 -178.989 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -71.67 29.54 0.05 OUTLIER 'General case' 0 CA--C 1.547 0.827 0 CA-C-N 115.76 -0.655 . . . . 0.0 112.673 -177.295 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 49.2 p 42.75 79.0 0.35 Allowed Pre-proline 0 C--N 1.348 0.522 0 C-N-CA 123.573 0.749 . . . . 0.0 111.528 178.711 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_exo -60.45 149.84 84.23 Favored 'Trans proline' 0 N--CA 1.449 -1.142 0 C-N-CA 122.529 2.152 . . . . 0.0 110.155 178.75 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 16.0 m -54.56 -55.67 26.89 Favored 'General case' 0 C--N 1.34 0.161 0 N-CA-C 110.259 -0.274 . . . . 0.0 110.259 -179.638 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . 58.41 -91.26 0.03 OUTLIER 'General case' 0 C--N 1.346 0.426 0 C-N-CA 123.203 0.601 . . . . 0.0 110.598 179.946 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 7.1 p -68.99 149.7 11.04 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 -179.654 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -161.39 -47.74 0.04 OUTLIER 'General case' 0 C--N 1.341 0.224 0 N-CA-C 110.125 -0.324 . . . . 0.0 110.125 -179.5 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 93.3 mtt-85 -64.21 -45.37 88.6 Favored 'General case' 0 C--N 1.34 0.186 0 N-CA-C 110.148 -0.316 . . . . 0.0 110.148 -179.445 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 10.0 m -67.49 167.99 11.75 Favored 'General case' 0 C--O 1.234 0.237 0 N-CA-C 109.98 -0.378 . . . . 0.0 109.98 179.815 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 87.8 mt -75.32 72.85 2.39 Favored 'General case' 0 CA--C 1.529 0.169 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 179.578 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 29.0 mmtp 56.34 -111.69 0.64 Allowed 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 -179.399 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.449 ' O ' HG22 ' A' ' 56' ' ' VAL . 9.9 p . . . . . 0 C--O 1.25 1.085 0 CA-C-O 116.769 -1.586 . . . . 0.0 110.467 -179.802 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 64.8 mtt . . . . . 0 N--CA 1.472 0.644 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 55.84 32.1 18.96 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 122.688 0.395 . . . . 0.0 110.809 -179.824 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 2.0 m -148.6 -56.51 0.21 Allowed 'General case' 0 C--N 1.343 0.287 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 178.33 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 19.6 tt -55.71 -37.9 48.6 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.444 0 N-CA-C 109.937 -0.394 . . . . 0.0 109.937 179.052 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -60.24 -64.15 1.05 Allowed 'General case' 0 N--CA 1.441 -0.91 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.295 -177.887 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -61.27 -52.82 63.15 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 122.963 0.505 . . . . 0.0 111.368 -178.177 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 86.2 t -59.36 -42.59 87.91 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.291 0 CA-C-O 119.517 -0.278 . . . . 0.0 111.272 -176.583 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -54.93 -53.71 52.05 Favored 'General case' 0 C--N 1.341 0.23 0 CA-C-N 118.014 0.37 . . . . 0.0 110.151 -179.128 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 20.1 mmmt -60.68 -47.92 84.12 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 110.006 -0.368 . . . . 0.0 110.006 -178.509 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.49 -37.16 77.52 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 116.455 -0.338 . . . . 0.0 110.624 -178.903 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -73.58 -47.84 37.45 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 122.089 0.156 . . . . 0.0 110.649 -178.489 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 50.1 t30 -171.25 139.78 1.38 Allowed 'General case' 0 C--N 1.347 0.485 0 N-CA-C 110.204 -0.295 . . . . 0.0 110.204 -177.562 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER 23.32 -87.3 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.954 0 C-N-CA 125.162 1.385 . . . . 0.0 112.811 177.636 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 71.8 m -151.18 -172.07 4.11 Favored 'General case' 0 C--N 1.348 0.518 0 C-N-CA 122.647 0.379 . . . . 0.0 110.074 -179.32 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 21.3 p -55.31 -16.19 3.19 Favored 'General case' 0 C--N 1.345 0.401 0 C-N-CA 123.253 0.621 . . . . 0.0 111.518 -179.053 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 4.7 m -52.41 -39.97 61.58 Favored 'General case' 0 CA--C 1.534 0.362 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 177.118 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 75.4 m -69.68 -40.17 76.54 Favored 'General case' 0 C--N 1.342 0.261 0 N-CA-C 109.95 -0.389 . . . . 0.0 109.95 179.054 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 84.0 t -59.46 -37.85 72.03 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.21 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 179.858 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 15.7 m -56.06 -39.12 71.55 Favored 'General case' 0 C--N 1.341 0.196 0 N-CA-C 110.067 -0.346 . . . . 0.0 110.067 179.146 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 23.8 m170 -62.57 -29.71 70.79 Favored 'General case' 0 C--O 1.223 -0.307 0 N-CA-C 110.155 -0.313 . . . . 0.0 110.155 179.991 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.594 HG22 ' HD2' ' A' ' 33' ' ' ARG . 5.1 t -80.42 -49.37 18.82 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.141 0 C-N-CA 122.202 0.201 . . . . 0.0 110.912 -177.97 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 78.9 mt -44.81 -53.99 1.35 Allowed 'Isoleucine or valine' 0 C--N 1.341 0.238 0 C-N-CA 122.811 0.444 . . . . 0.0 111.455 -175.675 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 10.4 p30 -114.43 26.74 10.0 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-O 119.861 -0.114 . . . . 0.0 110.923 -177.852 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 74.1 tttt 40.61 51.68 3.01 Favored 'General case' 0 C--N 1.346 0.437 0 C-N-CA 123.009 0.524 . . . . 0.0 110.68 179.62 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -67.12 -31.81 72.52 Favored 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 -179.811 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 59.2 ttt85 -158.1 111.86 2.49 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 179.658 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 48.8 p90 -78.53 136.71 37.63 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 109.205 -0.665 . . . . 0.0 109.205 179.425 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 57.3 t -112.44 83.74 0.69 Allowed 'Isoleucine or valine' 0 N--CA 1.457 -0.121 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 179.703 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 59.44 13.4 3.21 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 115.683 -0.689 . . . . 0.0 111.535 -179.335 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 71.17 -55.93 0.64 Allowed 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 123.912 0.885 . . . . 0.0 111.538 179.431 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -45.14 -46.92 12.22 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.355 0.662 . . . . 0.0 111.853 -177.805 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 32.1 m -58.86 -39.88 82.66 Favored 'General case' 0 N--CA 1.455 -0.207 0 O-C-N 122.226 -0.296 . . . . 0.0 110.266 -178.512 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.594 ' HD2' HG22 ' A' ' 21' ' ' VAL . 20.2 mmt180 -70.42 -40.47 73.8 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 -178.977 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 13.4 m-80 -61.9 -39.73 93.02 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 178.208 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -61.21 -52.17 65.9 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 109.959 -0.386 . . . . 0.0 109.959 179.468 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 53.4 t -55.17 -50.69 62.01 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 N-CA-C 110.116 -0.327 . . . . 0.0 110.116 178.844 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 10.5 m95 -58.59 -40.71 83.99 Favored 'General case' 0 C--N 1.341 0.224 0 N-CA-C 110.368 -0.234 . . . . 0.0 110.368 -179.73 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -62.61 -49.77 73.89 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 179.473 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -56.07 -41.87 75.79 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 122.42 0.288 . . . . 0.0 110.421 179.936 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.406 ' HA ' ' CE1' ' A' ' 45' ' ' TYR . 37.3 mt -61.71 -34.47 62.37 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 N-CA-C 110.461 -0.2 . . . . 0.0 110.461 -179.805 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 4.1 ttpm? -83.0 -36.58 24.91 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 122.362 0.265 . . . . 0.0 110.708 -177.3 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -77.54 -47.79 18.63 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 122.191 0.196 . . . . 0.0 111.502 -177.076 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 79.0 mt -76.98 -29.6 55.6 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-O 119.74 -0.172 . . . . 0.0 110.842 -177.897 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 6.3 m-70 73.78 121.98 0.04 OUTLIER 'General case' 0 C--N 1.344 0.362 0 C-N-CA 123.27 0.628 . . . . 0.0 109.632 -178.612 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.406 ' CE1' ' HA ' ' A' ' 40' ' ' ILE . 3.4 m-85 -105.67 -179.85 4.06 Favored 'General case' 0 N--CA 1.463 0.185 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 -179.724 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 8.3 p -154.8 69.23 5.73 Favored Pre-proline 0 CA--C 1.537 0.455 0 N-CA-C 109.034 -0.728 . . . . 0.0 109.034 176.814 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 7.6 Cg_endo -71.32 85.53 0.86 Allowed 'Trans proline' 0 N--CA 1.448 -1.151 0 C-N-CA 122.748 2.298 . . . . 0.0 110.271 -178.417 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 15.2 t 54.75 31.05 14.68 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 122.821 0.448 . . . . 0.0 110.435 -179.875 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -167.15 167.94 13.94 Favored 'General case' 0 N--CA 1.453 -0.28 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 -179.526 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 11.0 p -153.71 145.65 14.42 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.262 0 N-CA-C 109.141 -0.688 . . . . 0.0 109.141 179.612 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -70.17 -61.23 1.86 Allowed 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 109.708 -0.479 . . . . 0.0 109.708 -179.764 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 72.9 ttt-85 -160.04 78.74 0.68 Allowed 'General case' 0 N--CA 1.455 -0.209 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 179.802 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 70.2 m 55.86 -96.84 0.07 Allowed 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 122.727 0.411 . . . . 0.0 110.324 179.771 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -162.32 167.79 23.28 Favored 'General case' 0 N--CA 1.456 -0.174 0 N-CA-C 109.438 -0.579 . . . . 0.0 109.438 179.953 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 20.6 ttpp 75.42 -60.55 0.5 Allowed 'General case' 0 C--N 1.344 0.369 0 C-N-CA 123.672 0.789 . . . . 0.0 110.566 179.898 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 8.1 p . . . . . 0 C--O 1.253 1.246 0 CA-C-O 117.193 -1.384 . . . . 0.0 109.469 -179.611 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.5 ppp? . . . . . 0 N--CA 1.473 0.719 0 N-CA-C 110.12 -0.326 . . . . 0.0 110.12 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 62.21 178.09 0.13 Allowed 'General case' 0 C--N 1.347 0.479 0 C-N-CA 123.166 0.586 . . . . 0.0 110.524 -179.418 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' THR . . . . . 0.434 ' N ' ' CE2' ' A' ' 45' ' ' TYR . 0.4 OUTLIER 78.58 -29.04 0.15 Allowed 'General case' 0 C--N 1.35 0.597 0 C-N-CA 123.425 0.69 . . . . 0.0 110.713 178.11 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 7.1 mt -125.41 -38.85 1.01 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.54 0 C-N-CA 122.656 0.383 . . . . 0.0 110.819 -178.492 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 20.8 ttpp -49.67 -55.75 12.65 Favored 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 111.879 0.325 . . . . 0.0 111.879 -176.754 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 -79.86 -42.28 24.58 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 118.247 0.476 . . . . 0.0 110.553 -176.652 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 28.6 t -57.33 -35.03 47.62 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.36 0 C-N-CA 122.442 0.297 . . . . 0.0 110.586 -180.0 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -52.93 -66.09 0.44 Allowed 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 123.224 0.609 . . . . 0.0 111.042 -178.59 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.95 -35.79 72.33 Favored 'General case' 0 C--N 1.334 -0.107 0 CA-C-O 119.592 -0.242 . . . . 0.0 110.435 -178.971 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 12.5 tpt180 -55.26 -40.35 70.86 Favored 'General case' 0 C--N 1.341 0.206 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 178.743 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -68.78 -62.75 1.25 Allowed 'General case' 0 N--CA 1.448 -0.558 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 177.615 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -177.58 -88.24 0.0 OUTLIER 'General case' 0 C--N 1.351 0.667 0 N-CA-C 112.066 0.395 . . . . 0.0 112.066 178.585 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 55.7 t -69.23 -86.38 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.343 0.291 0 C-N-CA 122.476 0.31 . . . . 0.0 111.205 -174.473 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 9.0 t -158.48 -157.94 0.67 Allowed 'General case' 0 N--CA 1.45 -0.437 0 N-CA-C 110.173 -0.306 . . . . 0.0 110.173 -177.421 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 38.0 p -55.82 -30.17 60.95 Favored 'General case' 0 C--N 1.341 0.221 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.188 -179.532 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 16.6 p -49.94 -44.51 50.5 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 122.756 0.422 . . . . 0.0 110.219 179.127 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 21.3 m -53.24 -36.26 60.88 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 122.43 0.292 . . . . 0.0 110.477 -179.686 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 25.8 t -80.86 -44.26 21.18 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.294 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 179.627 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 14.8 m -55.21 -32.23 62.08 Favored 'General case' 0 C--N 1.344 0.357 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 -179.427 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 62.4 m170 -54.83 -64.72 0.74 Allowed 'General case' 0 N--CA 1.445 -0.696 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.157 179.356 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 15.7 t -62.36 -27.82 43.43 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.246 0 C-N-CA 120.997 -0.281 . . . . 0.0 111.396 -176.495 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 6.1 mm -65.69 -51.68 59.47 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.518 0 CA-C-N 117.872 0.306 . . . . 0.0 110.826 -178.818 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 8.9 p-10 -167.6 31.53 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 117.937 0.335 . . . . 0.0 111.556 -177.595 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 26.6 tptt -158.74 40.11 0.23 Allowed 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 120.69 -0.404 . . . . 0.0 110.624 -179.59 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 10.0 t -79.68 -31.02 41.3 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.664 -176.228 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 56.8 mtm180 57.36 -158.94 0.26 Allowed 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 109.549 -0.537 . . . . 0.0 109.549 179.962 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -80.4 99.17 7.83 Favored 'General case' 0 N--CA 1.453 -0.278 0 O-C-N 122.151 -0.343 . . . . 0.0 110.717 -178.006 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.0 m -143.69 161.55 16.26 Favored 'Isoleucine or valine' 0 C--O 1.233 0.221 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 175.955 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -74.0 170.17 15.98 Favored 'General case' 0 N--CA 1.446 -0.625 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 179.559 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 47.6 mm-40 -64.65 -18.01 64.56 Favored 'General case' 0 C--O 1.223 -0.306 0 N-CA-C 110.178 -0.304 . . . . 0.0 110.178 178.64 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -48.74 -55.14 12.3 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 122.943 0.497 . . . . 0.0 110.92 179.922 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 4.6 p -65.36 -41.22 94.07 Favored 'General case' 0 CA--C 1.531 0.243 0 O-C-N 122.378 -0.201 . . . . 0.0 111.045 -178.153 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 74.6 mtt85 -63.76 -53.66 47.56 Favored 'General case' 0 C--O 1.232 0.175 0 N-CA-C 111.375 0.139 . . . . 0.0 111.375 -177.205 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -69.36 -36.33 76.75 Favored 'General case' 0 C--O 1.223 -0.305 0 CA-C-O 119.677 -0.201 . . . . 0.0 110.732 -176.602 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -58.48 -50.69 72.83 Favored 'General case' 0 C--N 1.342 0.244 0 CA-C-N 117.843 0.292 . . . . 0.0 110.68 -178.99 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 48.7 t -58.06 -58.36 6.71 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.277 0 N-CA-C 110.559 -0.163 . . . . 0.0 110.559 -178.639 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 15.0 m95 -59.3 -40.26 85.65 Favored 'General case' 0 C--N 1.341 0.213 0 N-CA-C 110.747 -0.094 . . . . 0.0 110.747 -178.244 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -59.88 -50.8 72.35 Favored 'General case' 0 C--O 1.22 -0.455 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 -179.458 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -60.25 -47.74 84.71 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 122.026 0.131 . . . . 0.0 110.694 -179.199 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 58.5 mt -55.76 -47.41 79.41 Favored 'Isoleucine or valine' 0 C--N 1.341 0.2 0 C-N-CA 122.324 0.25 . . . . 0.0 111.105 -178.386 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -77.33 -41.14 41.67 Favored 'General case' 0 N--CA 1.448 -0.545 0 N-CA-C 110.372 -0.233 . . . . 0.0 110.372 -176.235 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -57.09 -48.46 78.56 Favored 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 110.161 -0.311 . . . . 0.0 110.161 -178.489 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 55.4 mt -83.7 -20.7 33.01 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.022 -178.458 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 91.4 m-70 55.89 26.53 9.85 Favored 'General case' 0 C--N 1.351 0.632 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 -176.956 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.434 ' CE2' ' N ' ' A' ' 3' ' ' THR . 16.6 t80 52.1 82.78 0.06 Allowed 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 123.319 0.648 . . . . 0.0 109.772 -175.541 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 22.8 t -109.98 104.1 54.86 Favored Pre-proline 0 CA--C 1.537 0.442 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 -179.866 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -69.79 176.19 7.12 Favored 'Trans proline' 0 N--CA 1.45 -1.048 0 C-N-CA 122.533 2.155 . . . . 0.0 110.536 179.902 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 15.0 m -54.51 -34.92 62.56 Favored 'General case' 0 C--N 1.342 0.257 0 CA-C-N 116.383 -0.372 . . . . 0.0 110.675 179.76 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -79.52 62.56 3.86 Favored 'General case' 0 C--N 1.342 0.272 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 179.772 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 59.4 t -60.31 -35.45 62.41 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 N-CA-C 109.88 -0.415 . . . . 0.0 109.88 -179.907 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -63.18 -25.4 68.33 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 122.44 0.296 . . . . 0.0 110.88 -179.721 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 72.3 mtp85 54.22 53.78 10.5 Favored 'General case' 0 C--N 1.346 0.454 0 N-CA-C 109.765 -0.458 . . . . 0.0 109.765 -179.074 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 27.6 m -148.41 36.86 0.82 Allowed 'General case' 0 CA--C 1.529 0.147 0 N-CA-C 109.914 -0.402 . . . . 0.0 109.914 179.678 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 3.0 mp -128.27 140.3 51.96 Favored 'General case' 0 C--N 1.341 0.235 0 N-CA-C 108.936 -0.764 . . . . 0.0 108.936 179.655 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 66.2 mttp -81.41 137.72 35.65 Favored 'General case' 0 N--CA 1.455 -0.199 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 179.939 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 58.3 t . . . . . 0 C--O 1.248 1.021 0 CA-C-O 116.945 -1.502 . . . . 0.0 108.863 179.932 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 57.9 ttm . . . . . 0 N--CA 1.475 0.78 0 N-CA-C 109.967 -0.382 . . . . 0.0 109.967 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -162.77 -88.26 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 179.808 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' THR . . . . . 0.564 HG22 ' H ' ' A' ' 4' ' ' ILE . 2.4 m 77.78 178.95 0.14 Allowed 'General case' 0 C--N 1.344 0.358 0 N-CA-C 108.384 -0.969 . . . . 0.0 108.384 178.698 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.564 ' H ' HG22 ' A' ' 3' ' ' THR . 1.0 OUTLIER -41.48 -36.57 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.347 0.468 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 179.004 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 26.2 mmtp -46.53 -62.07 1.53 Allowed 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 122.837 0.455 . . . . 0.0 111.187 179.043 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 30.1 m-20 -91.17 -32.46 15.8 Favored 'General case' 0 C--N 1.347 0.468 0 CA-C-N 117.909 0.322 . . . . 0.0 111.425 -176.337 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 70.4 t -58.12 -42.97 84.46 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 179.222 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.94 -42.64 97.27 Favored 'General case' 0 C--O 1.22 -0.451 0 N-CA-C 110.372 -0.233 . . . . 0.0 110.372 179.823 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 41.3 mtpt -61.34 -47.51 85.57 Favored 'General case' 0 C--N 1.338 0.108 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 179.627 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -55.19 -39.89 70.09 Favored 'General case' 0 N--CA 1.454 -0.233 0 N-CA-C 109.492 -0.559 . . . . 0.0 109.492 179.602 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -70.31 -56.55 6.45 Favored 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 110.368 -0.234 . . . . 0.0 110.368 179.847 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 45.2 t30 -170.91 126.34 0.7 Allowed 'General case' 0 C--N 1.347 0.487 0 CA-C-N 117.387 0.085 . . . . 0.0 111.194 -177.743 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 51.3 t 51.68 -91.31 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.539 0 C-N-CA 123.895 0.878 . . . . 0.0 111.809 176.419 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 28.3 m -157.44 -169.93 3.06 Favored 'General case' 0 C--N 1.346 0.417 0 N-CA-C 109.785 -0.45 . . . . 0.0 109.785 -177.591 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 80.4 p -49.87 -26.7 4.3 Favored 'General case' 0 C--N 1.347 0.496 0 C-N-CA 123.212 0.605 . . . . 0.0 111.104 -179.771 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 18.6 p -50.25 -44.19 53.42 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 122.396 0.279 . . . . 0.0 110.289 179.063 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.3 t -59.88 -37.63 79.89 Favored 'General case' 0 CA--C 1.534 0.333 0 N-CA-C 110.563 -0.162 . . . . 0.0 110.563 -178.621 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 64.6 t -68.62 -45.6 81.29 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.246 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 179.821 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 20.2 m -57.16 -45.74 83.35 Favored 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 179.076 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 52.2 m170 -57.66 -46.32 84.38 Favored 'General case' 0 C--N 1.339 0.152 0 C-N-CA 122.353 0.261 . . . . 0.0 110.373 -179.743 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 32.9 t -65.41 -51.93 58.04 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.05 -178.101 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 94.9 mt -59.49 -54.1 39.14 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.217 0 N-CA-C 110.377 -0.231 . . . . 0.0 110.377 -177.912 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 43.5 m-80 -70.61 -18.98 62.88 Favored 'General case' 0 CA--C 1.532 0.288 0 N-CA-C 110.386 -0.227 . . . . 0.0 110.386 -179.007 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 74.2 tttt 61.05 46.14 8.56 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 122.878 0.471 . . . . 0.0 109.928 179.476 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 15.8 p -96.25 -80.18 0.43 Allowed 'General case' 0 C--N 1.341 0.199 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 179.632 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 78.7 ttt180 -78.81 100.76 7.29 Favored 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 108.968 -0.752 . . . . 0.0 108.968 179.15 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 90.8 t80 -62.11 144.13 55.73 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 109.967 -0.383 . . . . 0.0 109.967 -179.995 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 5.4 m -130.67 170.8 18.83 Favored 'Isoleucine or valine' 0 CA--C 1.523 -0.081 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 179.463 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -61.78 158.4 15.85 Favored 'General case' 0 N--CA 1.45 -0.449 0 N-CA-C 109.978 -0.379 . . . . 0.0 109.978 179.796 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 50.7 mm-40 -48.73 -45.01 38.9 Favored 'General case' 0 C--N 1.34 0.178 0 CA-C-N 116.042 -0.526 . . . . 0.0 109.889 179.049 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -52.85 -53.7 45.07 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 122.715 0.406 . . . . 0.0 111.436 -178.146 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 10.0 m -61.15 -51.94 66.96 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 117.804 0.274 . . . . 0.0 110.817 -177.179 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 30.9 ttp180 -58.53 -52.76 64.27 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 122.02 0.128 . . . . 0.0 110.798 -177.931 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 90.5 m-20 -63.34 -40.67 97.94 Favored 'General case' 0 N--CA 1.455 -0.189 0 N-CA-C 110.465 -0.198 . . . . 0.0 110.465 -178.025 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -61.14 -47.85 84.31 Favored 'General case' 0 C--O 1.224 -0.258 0 N-CA-C 110.284 -0.265 . . . . 0.0 110.284 -179.885 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 13.1 t -54.31 -52.41 39.08 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 179.926 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 26.0 m95 -62.85 -38.21 89.9 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 110.059 -0.348 . . . . 0.0 110.059 179.874 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -89.01 28.12 1.24 Allowed 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 122.251 0.22 . . . . 0.0 110.606 179.784 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -131.14 -46.63 1.01 Allowed 'General case' 0 N--CA 1.456 -0.14 0 N-CA-C 108.474 -0.936 . . . . 0.0 108.474 176.76 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 60.7 mt -55.48 -46.77 78.9 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.224 0 N-CA-C 109.839 -0.43 . . . . 0.0 109.839 178.902 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 4.6 ptpp? -107.81 32.93 4.36 Favored 'General case' 0 C--N 1.344 0.365 0 C-N-CA 122.144 0.178 . . . . 0.0 110.634 -178.609 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -138.77 -55.75 0.61 Allowed 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 179.181 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -85.18 13.67 6.06 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 110.048 -0.352 . . . . 0.0 110.048 179.309 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 3.8 t-80 78.39 149.95 0.11 Allowed 'General case' 0 N--CA 1.446 -0.632 0 CA-C-O 121.807 0.813 . . . . 0.0 110.88 177.644 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 26.2 t80 -156.95 147.64 21.56 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 114.336 -1.302 . . . . 0.0 108.812 179.003 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 64.9 m -130.38 93.16 33.43 Favored Pre-proline 0 CA--C 1.533 0.31 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 -179.494 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 1.4 Cg_endo -65.86 170.85 10.76 Favored 'Trans proline' 0 N--CA 1.45 -1.086 0 C-N-CA 122.445 2.097 . . . . 0.0 110.656 179.526 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 12.9 p -75.14 151.15 38.57 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 109.759 -0.46 . . . . 0.0 109.759 179.562 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . 51.81 69.65 0.64 Allowed 'General case' 0 C--N 1.344 0.331 0 C-N-CA 122.863 0.465 . . . . 0.0 110.504 179.616 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.401 HG22 ' H ' ' A' ' 50' ' ' VAL . 3.3 m -70.65 79.75 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 179.6 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 57.73 29.94 18.16 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 122.993 0.517 . . . . 0.0 110.24 -179.563 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 44.7 mtm105 -147.01 114.65 6.4 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 -179.894 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 17.3 p -60.77 -54.48 44.74 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 109.449 -0.574 . . . . 0.0 109.449 179.488 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 6.2 tp 50.54 -125.57 2.25 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 109.719 -0.475 . . . . 0.0 109.719 179.115 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 83.2 tttt -159.56 124.53 4.05 Favored 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 179.548 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 32.6 m . . . . . 0 C--O 1.251 1.181 0 CA-C-O 116.086 -1.912 . . . . 0.0 110.817 -178.769 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.487 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 0.3 OUTLIER . . . . . 0 CA--C 1.54 0.567 0 N-CA-C 109.94 -0.392 . . . . 0.0 109.94 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 34.5 ttmt -55.55 -39.65 70.89 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 122.846 0.458 . . . . 0.0 111.081 -178.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -51.51 -64.93 0.65 Allowed 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 122.898 0.479 . . . . 0.0 111.414 -176.731 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 86.8 t -69.39 -31.81 50.87 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.371 0 N-CA-C 110.646 -0.131 . . . . 0.0 110.646 -177.211 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.04 -41.97 97.58 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 110.267 -0.272 . . . . 0.0 110.267 -179.888 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 31.4 mmtm -81.3 -31.58 33.53 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 122.439 0.296 . . . . 0.0 110.822 -179.168 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 1.3 tpm_? -75.64 -47.52 26.07 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 117.427 0.103 . . . . 0.0 111.047 -177.898 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -80.68 -49.03 11.74 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 122.163 0.185 . . . . 0.0 111.006 -177.073 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 22.4 m-80 -123.66 -145.41 0.34 Allowed 'General case' 0 C--N 1.341 0.23 0 N-CA-C 109.735 -0.469 . . . . 0.0 109.735 -177.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 58.6 t -102.22 -41.95 8.42 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.249 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 -179.902 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 8.3 t -155.16 176.85 12.02 Favored 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 109.925 -0.398 . . . . 0.0 109.925 -179.752 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 12.6 m -61.47 -21.47 64.2 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.617 -179.284 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 3.7 m -52.18 -49.16 64.38 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 110.179 -0.304 . . . . 0.0 110.179 179.379 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 7.1 m -65.43 -33.32 75.66 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 122.148 0.179 . . . . 0.0 110.722 -179.369 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 58.5 t -68.32 -45.58 82.31 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 -179.79 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 60.4 p -60.42 -35.72 76.47 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-O 119.731 -0.176 . . . . 0.0 110.739 -178.787 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 55.0 m170 -52.61 -37.54 58.45 Favored 'General case' 0 C--N 1.347 0.466 0 CA-C-O 120.568 0.223 . . . . 0.0 110.631 -179.882 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 60.1 t -72.35 -40.2 64.37 Favored 'Isoleucine or valine' 0 C--O 1.234 0.278 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.493 -178.88 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 76.2 mt -68.84 -56.18 13.04 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.194 0 C-N-CA 122.405 0.282 . . . . 0.0 110.514 -177.854 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 31.1 p30 -76.55 -10.92 59.74 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 119.701 -0.19 . . . . 0.0 111.216 -177.877 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 39.7 mtmt 56.45 38.7 29.91 Favored 'General case' 0 C--N 1.345 0.411 0 C-N-CA 122.674 0.389 . . . . 0.0 110.319 179.257 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 10.3 t -82.23 -34.18 28.97 Favored 'General case' 0 C--N 1.34 0.155 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 179.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 89.2 mtt-85 -134.18 69.97 1.46 Allowed 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 178.236 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 87.5 t80 -59.47 111.16 1.29 Allowed 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 116.097 -0.501 . . . . 0.0 109.78 -179.038 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.577 HG12 ' H ' ' A' ' 29' ' ' ALA . 12.0 t -76.13 173.68 0.93 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 179.31 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.577 ' H ' HG12 ' A' ' 28' ' ' VAL . . . -76.89 52.61 0.87 Allowed 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 122.337 0.255 . . . . 0.0 111.455 -178.056 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 69.08 -32.16 0.22 Allowed 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.025 0.93 . . . . 0.0 112.975 177.023 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 51.6 mt-10 -50.87 -61.93 1.91 Allowed 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 118.52 0.6 . . . . 0.0 110.836 -177.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 45.5 m -61.14 -41.19 96.29 Favored 'General case' 0 C--O 1.225 -0.204 0 CA-C-N 116.738 -0.21 . . . . 0.0 110.599 -178.482 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 12.1 ttm180 -56.04 -55.39 33.4 Favored 'General case' 0 CA--C 1.531 0.247 0 N-CA-C 110.286 -0.265 . . . . 0.0 110.286 -179.152 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 21.5 m120 -61.84 -46.05 91.14 Favored 'General case' 0 N--CA 1.455 -0.201 0 N-CA-C 110.282 -0.266 . . . . 0.0 110.282 -179.353 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -56.84 -43.07 80.74 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 122.194 0.198 . . . . 0.0 110.785 -179.12 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 16.4 t -63.43 -57.47 11.72 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.184 0 N-CA-C 110.339 -0.245 . . . . 0.0 110.339 -178.875 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 19.0 m95 -58.87 -37.79 77.35 Favored 'General case' 0 CA--C 1.53 0.197 0 N-CA-C 110.682 -0.118 . . . . 0.0 110.682 -178.466 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -66.02 -53.13 42.52 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 109.953 -0.388 . . . . 0.0 109.953 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.96 -41.62 87.93 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 122.54 0.336 . . . . 0.0 110.893 -178.611 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 19.7 mt -53.37 -46.14 57.67 Favored 'Isoleucine or valine' 0 C--N 1.34 0.194 0 C-N-CA 122.218 0.207 . . . . 0.0 110.547 -179.38 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 7.8 mtpm? -79.82 -37.35 35.28 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 110.303 -0.258 . . . . 0.0 110.303 -177.848 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -59.34 -57.28 13.68 Favored 'General case' 0 N--CA 1.451 -0.379 0 N-CA-C 110.109 -0.33 . . . . 0.0 110.109 -178.523 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -70.91 -43.21 68.76 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 -179.68 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 9.9 t60 65.03 118.72 0.02 OUTLIER 'General case' 0 C--N 1.349 0.567 0 C-N-CA 123.462 0.705 . . . . 0.0 110.091 -178.834 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.487 ' CE2' ' HA ' ' A' ' 4' ' ' ILE . 0.0 OUTLIER . . . . . 0 CA--C 1.53 0.194 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.276 -179.4 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 15.3 tt . . . . . 0 N--CA 1.467 0.404 0 CA-C-O 120.389 0.137 . . . . 0.0 111.214 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 3.6 mmmm -70.19 -58.96 3.19 Favored 'General case' 0 N--CA 1.447 -0.576 0 N-CA-C 110.175 -0.305 . . . . 0.0 110.175 -179.735 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -59.83 -56.75 17.89 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 123.403 0.44 . . . . 0.0 111.749 -176.948 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.508 HG23 ' H ' ' A' ' 8' ' ' ALA . 17.1 m -43.55 -56.07 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 C-N-CA 122.83 0.452 . . . . 0.0 112.196 -174.039 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.508 ' H ' HG23 ' A' ' 7' ' ' VAL . . . -48.17 -50.24 29.7 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.769 -178.329 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 8.5 mptt -74.66 -34.32 62.69 Favored 'General case' 0 CA--C 1.534 0.347 0 O-C-N 122.436 -0.165 . . . . 0.0 110.736 -178.496 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 11.0 mmt-85 -58.78 -56.19 25.4 Favored 'General case' 0 C--N 1.341 0.205 0 N-CA-C 109.502 -0.555 . . . . 0.0 109.502 179.093 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -68.96 -8.23 42.64 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.688 179.498 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 60.9 63.11 1.33 Allowed 'General case' 0 C--N 1.343 0.291 0 C-N-CA 123.018 0.527 . . . . 0.0 110.254 178.963 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 2.1 m -137.2 -109.48 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.455 -0.191 0 N-CA-C 108.518 -0.919 . . . . 0.0 108.518 177.677 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 10.0 p -169.25 147.05 3.67 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 179.812 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 9.3 t -51.39 -33.06 28.38 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.534 179.552 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 20.2 p -49.83 -54.21 20.76 Favored 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 109.863 -0.421 . . . . 0.0 109.863 179.075 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 10.5 m -53.31 -46.05 69.23 Favored 'General case' 0 N--CA 1.456 -0.151 0 C-N-CA 122.63 0.372 . . . . 0.0 110.094 179.466 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 20.1 t -64.85 -27.08 41.62 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.18 0 CA-C-N 116.433 -0.348 . . . . 0.0 110.824 -178.577 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 45.2 m -77.42 -48.86 16.12 Favored 'General case' 0 CA--C 1.506 -0.732 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 179.844 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 18.2 m-70 -55.54 -39.82 71.08 Favored 'General case' 0 C--O 1.201 -1.47 0 O-C-N 123.329 0.393 . . . . 0.0 110.046 -179.626 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 19.6 t -52.16 -32.89 16.12 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.389 0 CA-C-N 118.192 0.451 . . . . 0.0 110.784 -179.367 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 32.1 mm -75.33 -34.96 31.89 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.415 0 N-CA-C 111.989 0.366 . . . . 0.0 111.989 -177.738 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.3 p-10 -100.56 -40.32 7.47 Favored 'General case' 0 N--CA 1.481 1.097 0 CA-C-N 118.398 0.545 . . . . 0.0 111.337 -176.486 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.821 ' O ' HG23 ' A' ' 25' ' ' THR . 36.2 ttpt -153.74 -89.89 0.05 OUTLIER 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 108.13 -1.063 . . . . 0.0 108.13 179.142 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . 0.821 HG23 ' O ' ' A' ' 24' ' ' LYS . 0.8 OUTLIER 173.53 -41.75 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.294 0.637 . . . . 0.0 110.283 177.605 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 38.3 ttt85 57.91 46.12 17.22 Favored 'General case' 0 CA--C 1.535 0.385 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 -178.099 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 22.5 t80 74.19 126.18 0.04 OUTLIER 'General case' 0 C--N 1.346 0.456 0 C-N-CA 123.615 0.766 . . . . 0.0 110.684 -179.804 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 5.8 m -141.96 168.06 15.17 Favored 'Isoleucine or valine' 0 C--N 1.342 0.254 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 178.766 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -100.59 25.78 7.43 Favored 'General case' 0 CA--C 1.531 0.218 0 N-CA-C 109.897 -0.409 . . . . 0.0 109.897 179.38 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 68.5 -65.81 0.26 Allowed 'General case' 0 C--N 1.352 0.684 0 C-N-CA 123.909 0.883 . . . . 0.0 110.704 -179.398 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 68.1 mt-10 -53.54 -33.71 55.59 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 122.775 0.43 . . . . 0.0 110.803 -179.824 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 9.9 p -66.8 -54.81 18.76 Favored 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 -179.374 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 2.4 tmt_? -55.53 -45.64 77.14 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 110.079 -0.341 . . . . 0.0 110.079 179.821 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 86.6 m-20 -64.43 -48.74 74.2 Favored 'General case' 0 CA--C 1.53 0.199 0 N-CA-C 110.493 -0.188 . . . . 0.0 110.493 -179.073 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -58.04 -43.63 86.91 Favored 'General case' 0 C--N 1.34 0.157 0 N-CA-C 110.336 -0.246 . . . . 0.0 110.336 -179.455 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 21.7 t -56.81 -54.21 32.44 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.214 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 179.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 18.0 m95 -60.66 -39.88 90.01 Favored 'General case' 0 N--CA 1.456 -0.154 0 N-CA-C 110.568 -0.16 . . . . 0.0 110.568 -179.532 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -58.83 -52.37 66.01 Favored 'General case' 0 N--CA 1.455 -0.193 0 N-CA-C 109.946 -0.39 . . . . 0.0 109.946 -179.067 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -62.62 -44.52 96.08 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 122.294 0.238 . . . . 0.0 110.508 -179.774 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 29.4 mt -58.12 -39.11 71.45 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.196 0 N-CA-C 110.247 -0.279 . . . . 0.0 110.247 -179.658 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 65.2 mmtt -78.1 -34.11 50.27 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 109.925 -0.398 . . . . 0.0 109.925 -178.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -63.85 -58.48 6.66 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 110.407 -0.22 . . . . 0.0 110.407 -178.946 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 79.2 mt -85.62 -2.13 57.85 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 122.223 0.209 . . . . 0.0 110.913 -178.547 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 4.4 m-70 63.71 13.37 7.34 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 123.137 0.575 . . . . 0.0 110.767 -179.42 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 7.6 t80 . . . . . 0 C--N 1.347 0.472 0 C-N-CA 124.035 0.934 . . . . 0.0 111.153 -178.7 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.418 ' O ' HD13 ' A' ' 4' ' ' ILE . 0.1 OUTLIER . . . . . 0 CA--C 1.536 0.437 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 27.1 mmtp -59.52 -58.79 7.04 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 120.733 0.301 . . . . 0.0 110.381 -178.552 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -57.36 -50.64 72.32 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.624 -179.121 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.485 HG22 HD12 ' A' ' 43' ' ' LEU . 29.3 t -53.66 -54.51 18.74 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.092 0 C-N-CA 123.045 0.538 . . . . 0.0 110.491 -179.715 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -55.09 -58.61 6.95 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.728 -177.332 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 32.6 mtmm -59.63 -34.57 72.95 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 110.422 -0.214 . . . . 0.0 110.422 -177.775 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 49.2 tpt85 -64.91 -35.12 80.13 Favored 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 177.061 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -84.56 8.21 17.42 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 122.691 0.396 . . . . 0.0 110.256 178.236 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 8.1 t-20 69.98 42.42 1.02 Allowed 'General case' 0 C--N 1.346 0.447 0 C-N-CA 123.974 0.909 . . . . 0.0 111.454 177.424 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 3.6 m -145.16 143.35 22.27 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.518 0 N-CA-C 108.21 -1.033 . . . . 0.0 108.21 176.03 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 74.3 m -71.7 -65.65 0.73 Allowed 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.865 -0.42 . . . . 0.0 109.865 -178.257 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 5.2 t 179.71 -33.02 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 123.964 0.905 . . . . 0.0 108.869 -179.753 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 11.7 p -57.84 -49.08 77.89 Favored 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 178.272 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 12.0 m -56.76 -36.09 69.4 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 110.228 -0.286 . . . . 0.0 110.228 179.215 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 71.6 t -69.99 -38.47 75.42 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.178 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 178.218 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 17.4 m -61.66 -33.36 73.84 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 109.755 -0.461 . . . . 0.0 109.755 179.152 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 50.8 m170 -61.29 -30.48 70.51 Favored 'General case' 0 C--N 1.346 0.431 0 N-CA-C 110.385 -0.228 . . . . 0.0 110.385 179.496 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 93.1 t -63.96 -52.04 61.67 Favored 'Isoleucine or valine' 0 C--N 1.341 0.215 0 N-CA-C 109.522 -0.547 . . . . 0.0 109.522 179.911 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 4.8 mm -64.41 -49.96 78.42 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.164 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 179.656 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 33.8 t-20 -59.86 -31.75 70.06 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 116.528 -0.305 . . . . 0.0 110.205 -179.262 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 31.9 ttpt 64.34 46.02 3.61 Favored 'General case' 0 CA--C 1.532 0.282 0 N-CA-C 109.503 -0.555 . . . . 0.0 109.503 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 15.2 p -115.55 -87.06 0.6 Allowed 'General case' 0 C--N 1.341 0.233 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 -179.847 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 47.5 mmm-85 -94.73 54.6 1.78 Allowed 'General case' 0 C--O 1.233 0.22 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 -179.34 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 27.6 p90 -72.57 144.24 47.98 Favored 'General case' 0 N--CA 1.453 -0.287 0 N-CA-C 109.379 -0.601 . . . . 0.0 109.379 179.7 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 19.7 t -87.54 80.1 1.77 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.286 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 -179.548 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 54.55 -143.33 0.74 Allowed 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.203 179.397 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 69.1 mt-10 -115.05 -25.27 8.2 Favored 'General case' 0 CA--C 1.528 0.125 0 C-N-CA 122.892 0.477 . . . . 0.0 110.284 179.705 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 70.0 mm-40 -55.24 -61.8 2.09 Favored 'General case' 0 C--O 1.232 0.163 0 N-CA-C 110.148 -0.315 . . . . 0.0 110.148 -179.783 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 9.6 m -62.65 -40.1 95.96 Favored 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 179.925 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 13.9 ttm180 -52.03 -48.96 64.3 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 122.701 0.4 . . . . 0.0 110.308 -179.657 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 22.4 t-20 -71.09 -47.52 57.76 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.336 -179.174 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -54.63 -39.79 68.31 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 122.42 0.288 . . . . 0.0 110.945 -178.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 17.5 t -60.39 -60.88 1.91 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.279 0 N-CA-C 109.84 -0.43 . . . . 0.0 109.84 -179.524 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 26.0 m95 -58.34 -37.33 74.94 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-O 119.969 -0.062 . . . . 0.0 110.946 -178.196 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -61.37 -55.93 26.07 Favored 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 109.808 -0.442 . . . . 0.0 109.808 179.069 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.5 -42.49 87.78 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 122.611 0.364 . . . . 0.0 110.895 -179.033 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 27.4 mt -52.71 -56.87 5.51 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.193 0 C-N-CA 122.54 0.336 . . . . 0.0 110.703 -178.779 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -83.67 0.09 48.47 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-O 119.6 -0.238 . . . . 0.0 111.541 -176.818 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.6 tm-20 -88.7 -46.48 8.98 Favored 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 109.181 -0.674 . . . . 0.0 109.181 179.435 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.485 HD12 HG22 ' A' ' 7' ' ' VAL . 6.9 mt -72.38 -92.32 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 119.27 -0.395 . . . . 0.0 110.71 -178.514 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 54.9 m80 -158.79 18.0 0.2 Allowed 'General case' 0 C--N 1.352 0.694 0 N-CA-C 112.763 0.653 . . . . 0.0 112.763 -175.608 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 66.7 t80 . . . . . 0 N--CA 1.464 0.234 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 179.003 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.1 mt . . . . . 0 CA--C 1.541 0.625 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -82.29 -58.06 3.1 Favored 'General case' 0 N--CA 1.45 -0.454 0 C-N-CA 123.412 0.685 . . . . 0.0 110.41 -177.588 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 32.9 m-20 -82.23 -34.24 28.95 Favored 'General case' 0 C--O 1.224 -0.268 0 N-CA-C 110.377 -0.231 . . . . 0.0 110.377 -177.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 31.2 t -54.16 -52.56 36.48 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.259 0 N-CA-C 110.092 -0.336 . . . . 0.0 110.092 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.65 -45.73 88.84 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-O 120.499 0.19 . . . . 0.0 110.663 -178.853 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 18.3 mmtp -67.1 -24.71 65.96 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-O 119.614 -0.231 . . . . 0.0 111.224 -178.132 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 1.6 tmm_? -60.65 -43.61 97.38 Favored 'General case' 0 C--N 1.343 0.316 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 177.887 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -85.18 -0.28 54.08 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 178.466 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 67.39 48.73 1.11 Allowed 'General case' 0 C--N 1.345 0.411 0 C-N-CA 123.202 0.601 . . . . 0.0 110.268 178.651 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 27.6 m -143.22 174.1 5.28 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 178.531 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 21.3 m -88.69 161.84 16.62 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 122.672 0.389 . . . . 0.0 110.074 -179.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 14.1 t -56.4 -32.35 64.73 Favored 'General case' 0 N--CA 1.463 0.223 0 C-N-CA 122.509 0.324 . . . . 0.0 110.763 -179.851 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 13.8 p -58.86 -45.62 89.69 Favored 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 178.823 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -55.94 -42.35 76.03 Favored 'General case' 0 N--CA 1.453 -0.278 0 N-CA-C 109.884 -0.413 . . . . 0.0 109.884 179.612 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 78.5 t -64.87 -43.47 96.33 Favored 'Isoleucine or valine' 0 C--N 1.34 0.177 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 179.185 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 14.4 t -57.67 -37.25 73.09 Favored 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 110.151 -0.314 . . . . 0.0 110.151 179.622 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 54.7 m170 -59.13 -28.07 66.21 Favored 'General case' 0 C--N 1.344 0.332 0 N-CA-C 110.398 -0.223 . . . . 0.0 110.398 -179.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 36.7 t -77.79 -43.69 29.0 Favored 'Isoleucine or valine' 0 C--O 1.232 0.154 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 178.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 77.2 mt -57.98 -58.42 6.44 Favored 'Isoleucine or valine' 0 C--N 1.34 0.163 0 N-CA-C 109.519 -0.548 . . . . 0.0 109.519 -179.436 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 26.5 p30 -73.84 -14.42 61.08 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 110.283 -0.266 . . . . 0.0 110.283 -179.849 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 62.22 32.63 17.15 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 122.978 0.511 . . . . 0.0 111.254 177.035 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 14.8 t -70.23 -29.32 66.12 Favored 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 177.56 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 74.3 mtt85 -141.81 98.33 3.32 Favored 'General case' 0 C--N 1.343 0.309 0 N-CA-C 108.115 -1.069 . . . . 0.0 108.115 178.148 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 88.5 t80 -65.88 108.6 2.21 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 110.234 -0.284 . . . . 0.0 110.234 -178.601 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 30.3 m -72.82 172.88 0.96 Allowed 'Isoleucine or valine' 0 N--CA 1.457 -0.118 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 178.235 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -65.03 159.3 23.44 Favored 'General case' 0 N--CA 1.449 -0.477 0 N-CA-C 109.684 -0.487 . . . . 0.0 109.684 178.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 29.5 mm-40 -50.63 -43.01 56.86 Favored 'General case' 0 C--O 1.223 -0.336 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.155 179.473 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 9.5 tm-20 -52.17 -53.23 45.68 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 122.217 0.207 . . . . 0.0 110.632 -179.364 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 10.0 m -65.55 -52.66 50.75 Favored 'General case' 0 N--CA 1.442 -0.855 0 CA-C-O 119.593 -0.242 . . . . 0.0 111.453 -175.25 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 6.8 ppt_? -62.19 -39.51 92.97 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 118.277 0.49 . . . . 0.0 110.958 -176.784 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 49.2 m-80 -67.17 -46.61 73.47 Favored 'General case' 0 C--N 1.34 0.194 0 N-CA-C 109.549 -0.537 . . . . 0.0 109.549 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -58.64 -42.01 87.36 Favored 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 110.21 -0.293 . . . . 0.0 110.21 179.717 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 18.8 t -63.94 -58.3 7.92 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.216 0 C-N-CA 122.381 0.272 . . . . 0.0 110.314 -179.514 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 19.3 m95 -57.87 -37.76 74.51 Favored 'General case' 0 C--N 1.342 0.261 0 N-CA-C 110.444 -0.206 . . . . 0.0 110.444 -178.371 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -64.13 -52.55 58.59 Favored 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 179.266 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -55.74 -45.46 78.0 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 122.449 0.3 . . . . 0.0 111.038 -178.602 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 46.5 mt -55.26 -43.53 71.33 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 C-N-CA 122.2 0.2 . . . . 0.0 110.985 -178.116 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 36.6 mtmm -78.32 -43.54 27.61 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 109.983 -0.377 . . . . 0.0 109.983 -177.541 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 24.0 mm-40 -57.15 -47.77 80.36 Favored 'General case' 0 N--CA 1.448 -0.542 0 O-C-N 123.152 0.282 . . . . 0.0 110.761 -178.466 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -85.52 -0.68 55.69 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-O 119.669 -0.205 . . . . 0.0 110.636 -178.876 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 21.2 m80 57.14 38.47 29.01 Favored 'General case' 0 C--N 1.345 0.406 0 C-N-CA 122.651 0.38 . . . . 0.0 110.689 178.687 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 1.5 m-85 . . . . . 0 C--N 1.327 -0.397 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.258 179.791 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 21.3 tt . . . . . 0 C--O 1.226 -0.177 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -60.47 -60.25 4.11 Favored 'General case' 0 N--CA 1.447 -0.608 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 178.993 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 29.2 m-20 -54.22 -43.36 70.75 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.262 179.379 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 42.8 t -59.53 -36.67 66.12 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.28 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 178.409 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -68.11 -40.04 82.63 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 110.273 -0.269 . . . . 0.0 110.273 179.755 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 52.9 mttt -62.48 -40.44 96.69 Favored 'General case' 0 C--N 1.343 0.289 0 N-CA-C 108.485 -0.931 . . . . 0.0 108.485 177.733 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 27.1 mtt180 -60.03 -43.58 95.2 Favored 'General case' 0 C--N 1.341 0.229 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 176.415 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -73.77 9.85 1.33 Allowed 'General case' 0 CA--C 1.541 0.635 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.632 177.023 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 8.1 m-80 75.07 149.19 0.1 Allowed 'General case' 0 C--N 1.353 0.739 0 C-N-CA 124.296 1.038 . . . . 0.0 111.613 177.199 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 40.8 t 64.02 -86.6 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.455 -0.18 0 CA-C-N 114.393 -1.276 . . . . 0.0 110.559 177.116 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 9.3 t -174.88 -162.74 0.12 Allowed 'General case' 0 C--O 1.233 0.234 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 -177.045 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 20.0 p -57.91 -19.93 33.49 Favored 'General case' 0 C--O 1.222 -0.347 0 C-N-CA 123.133 0.573 . . . . 0.0 111.314 -179.282 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 4.6 m -53.5 -49.51 67.38 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 110.277 -0.268 . . . . 0.0 110.277 179.668 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 26.1 m -62.4 -44.3 96.78 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 110.296 -0.261 . . . . 0.0 110.296 -179.289 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 92.6 t -61.29 -42.25 92.84 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 -179.839 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 50.3 m -61.3 -40.72 95.21 Favored 'General case' 0 N--CA 1.454 -0.243 0 N-CA-C 110.159 -0.311 . . . . 0.0 110.159 -179.496 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 47.0 m170 -59.36 -41.3 88.93 Favored 'General case' 0 C--N 1.339 0.149 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 -179.825 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 54.0 t -70.47 -52.48 28.93 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 O-C-N 123.035 0.21 . . . . 0.0 110.791 -178.674 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 93.1 mt -63.44 -51.87 65.22 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 N-CA-C 110.393 -0.225 . . . . 0.0 110.393 -177.635 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 14.6 t-20 -68.56 -34.88 76.6 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-O 119.665 -0.207 . . . . 0.0 110.517 -178.483 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 23.1 mtmm 70.56 60.09 0.22 Allowed 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 123.373 0.669 . . . . 0.0 109.507 -179.398 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 19.3 p -87.33 -80.35 0.26 Allowed 'General case' 0 C--N 1.34 0.167 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 179.201 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 8.7 ptm180 -86.76 163.1 17.48 Favored 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 109.843 -0.429 . . . . 0.0 109.843 179.41 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 89.1 t80 -80.99 142.25 33.62 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 179.617 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 9.0 m -141.17 158.19 22.61 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.183 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 178.544 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -73.22 160.2 32.28 Favored 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 179.499 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 15.1 mm-40 -58.53 -24.38 60.47 Favored 'General case' 0 C--O 1.223 -0.298 0 N-CA-C 110.099 -0.334 . . . . 0.0 110.099 179.071 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.7 tm-20 -56.21 -53.01 62.28 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 109.705 -0.48 . . . . 0.0 109.705 178.034 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 3.9 m -64.03 -48.68 75.35 Favored 'General case' 0 N--CA 1.449 -0.517 0 C-N-CA 122.247 0.219 . . . . 0.0 110.477 -177.487 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 28.3 mtm180 -57.84 -54.25 48.99 Favored 'General case' 0 CA--C 1.528 0.119 0 N-CA-C 110.051 -0.351 . . . . 0.0 110.051 -179.16 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 48.6 t30 -57.73 -48.82 78.51 Favored 'General case' 0 C--O 1.224 -0.272 0 C-N-CA 122.785 0.434 . . . . 0.0 110.339 -178.828 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -55.85 -47.16 77.77 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 122.112 0.165 . . . . 0.0 110.651 -178.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 39.2 t -63.44 -56.4 17.29 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.15 0 N-CA-C 110.474 -0.195 . . . . 0.0 110.474 -178.82 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 19.5 m95 -57.21 -40.19 76.99 Favored 'General case' 0 C--O 1.233 0.202 0 N-CA-C 110.516 -0.179 . . . . 0.0 110.516 -178.56 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -64.09 -49.59 71.65 Favored 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 -179.781 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -70.44 0.15 7.21 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-O 119.499 -0.286 . . . . 0.0 111.536 -178.68 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 21.8 mt -102.91 -46.72 10.83 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.195 0 N-CA-C 109.899 -0.408 . . . . 0.0 109.899 178.895 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 1.1 ttpm? -93.19 -30.35 15.26 Favored 'General case' 0 C--N 1.343 0.318 0 N-CA-C 112.25 0.463 . . . . 0.0 112.25 -176.078 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 49.5 mm-40 -86.46 -30.56 21.93 Favored 'General case' 0 C--N 1.34 0.172 0 CA-C-N 118.371 0.532 . . . . 0.0 110.558 -177.72 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -73.76 -29.1 62.02 Favored 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 110.356 -0.239 . . . . 0.0 110.356 -179.323 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 19.1 m80 59.57 57.73 3.16 Favored 'General case' 0 C--N 1.346 0.426 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 -179.481 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 9.2 p90 . . . . . 0 C--N 1.319 -0.739 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.896 -178.631 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.221 -0.406 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 28.9 mtpp -58.51 -64.92 0.75 Allowed 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 122.492 0.317 . . . . 0.0 110.757 -178.763 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -58.9 -44.85 91.28 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.64 -0.254 . . . . 0.0 110.623 -179.379 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 53.5 t -56.53 -45.2 82.07 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 179.577 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.6 -45.09 91.92 Favored 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 110.397 -0.224 . . . . 0.0 110.397 -179.74 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 34.9 mtmm -58.55 -41.49 85.71 Favored 'General case' 0 C--N 1.341 0.237 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 178.512 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.43 -35.23 76.98 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 108.748 -0.834 . . . . 0.0 108.748 177.911 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -88.58 15.64 7.76 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.471 178.458 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 64.2 t30 85.26 145.91 0.06 Allowed 'General case' 0 C--N 1.353 0.738 0 C-N-CA 124.281 1.032 . . . . 0.0 111.487 177.74 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 4.9 t 65.24 -116.6 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.471 0 CA-C-N 114.907 -1.042 . . . . 0.0 109.814 178.461 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 7.9 t -166.25 -161.69 0.49 Allowed 'General case' 0 C--N 1.344 0.341 0 CA-C-N 118.491 0.587 . . . . 0.0 110.247 -178.758 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 39.1 p -54.26 -23.32 14.41 Favored 'General case' 0 C--N 1.342 0.261 0 C-N-CA 123.189 0.596 . . . . 0.0 111.744 -177.881 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 13.2 t -56.2 -38.53 71.11 Favored 'General case' 0 C--O 1.222 -0.385 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 179.257 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 58.0 m -65.72 -35.32 80.42 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 109.922 -0.399 . . . . 0.0 109.922 179.767 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 62.3 t -69.98 -52.71 28.48 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.336 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 179.868 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 85.3 p -53.42 -40.31 65.02 Favored 'General case' 0 C--N 1.343 0.298 0 N-CA-C 110.524 -0.176 . . . . 0.0 110.524 -178.634 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 57.7 m170 -54.05 -36.41 63.04 Favored 'General case' 0 C--N 1.345 0.386 0 C-N-CA 122.27 0.228 . . . . 0.0 110.396 179.112 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 59.2 t -78.49 -35.02 18.57 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.224 0 CA-C-N 116.687 -0.233 . . . . 0.0 110.397 -179.288 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 25.5 mm -67.23 -50.84 59.4 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.218 0 CA-C-N 117.889 0.313 . . . . 0.0 110.214 -179.285 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 34.6 p30 -87.27 -8.67 56.52 Favored 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 111.674 0.25 . . . . 0.0 111.674 -177.645 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 54.25 36.75 25.84 Favored 'General case' 0 C--N 1.345 0.399 0 C-N-CA 122.616 0.367 . . . . 0.0 110.388 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 7.0 t -82.12 -30.1 31.34 Favored 'General case' 0 CA--C 1.531 0.247 0 N-CA-C 110.307 -0.257 . . . . 0.0 110.307 -179.291 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 60.1 mtp85 -128.31 116.95 20.61 Favored 'General case' 0 C--N 1.344 0.344 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 47.4 t80 -71.72 108.38 5.02 Favored 'General case' 0 N--CA 1.453 -0.285 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 -179.668 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 4.6 m -107.35 38.55 0.37 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.376 0 C-N-CA 122.551 0.341 . . . . 0.0 110.549 -178.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 60.73 -179.91 0.1 Allowed 'General case' 0 C--N 1.343 0.302 0 CA-C-O 121.111 0.482 . . . . 0.0 111.179 178.869 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 58.1 mm-40 -77.77 -25.64 49.23 Favored 'General case' 0 C--O 1.223 -0.298 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.286 179.693 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -58.3 -64.92 0.75 Allowed 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 110.471 -0.196 . . . . 0.0 110.471 -178.666 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 2.2 m -61.26 -44.29 97.48 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 110.091 -0.337 . . . . 0.0 110.091 -178.674 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 44.1 ttm105 -53.54 -55.8 22.49 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 122.826 0.451 . . . . 0.0 110.613 -179.336 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -63.36 -48.03 79.65 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 122.424 0.289 . . . . 0.0 110.496 -178.873 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.65 -47.32 70.46 Favored 'General case' 0 C--N 1.34 0.157 0 C-N-CA 122.187 0.195 . . . . 0.0 110.674 -178.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 37.9 t -62.78 -57.41 12.16 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.223 0 N-CA-C 110.173 -0.306 . . . . 0.0 110.173 -179.484 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 13.1 m95 -56.57 -32.13 64.89 Favored 'General case' 0 C--N 1.343 0.283 0 CA-C-N 117.463 0.119 . . . . 0.0 110.946 -178.235 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -71.59 -67.48 0.52 Allowed 'General case' 0 N--CA 1.447 -0.581 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 179.075 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -48.08 -40.54 23.58 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 122.692 0.397 . . . . 0.0 111.555 -178.11 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 1.5 mm -44.71 -54.4 1.23 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.206 0 C-N-CA 123.095 0.558 . . . . 0.0 111.27 -178.326 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 24.3 pttm -100.84 -31.78 10.99 Favored 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 112.187 0.44 . . . . 0.0 112.187 -176.112 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 76.1 mm-40 -73.5 -40.19 64.25 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 118.04 0.382 . . . . 0.0 110.989 -176.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.0 tt -77.33 -36.43 53.93 Favored 'General case' 0 CA--C 1.527 0.084 0 N-CA-C 110.179 -0.304 . . . . 0.0 110.179 -178.688 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 15.2 m80 76.93 134.28 0.06 Allowed 'General case' 0 C--N 1.346 0.444 0 C-N-CA 123.619 0.768 . . . . 0.0 109.735 -178.975 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 3.7 p90 . . . . . 0 CA--C 1.532 0.272 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 178.301 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.224 -0.286 0 N-CA-C 110.246 -0.279 . . . . 0.0 110.246 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 58.2 mtmt -48.43 -63.05 1.19 Allowed 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 122.947 0.499 . . . . 0.0 110.583 179.41 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -58.38 -44.97 89.15 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.722 -178.45 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 97.1 t -57.12 -43.34 81.27 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.184 0 N-CA-C 110.319 -0.252 . . . . 0.0 110.319 -179.168 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.71 -40.08 93.78 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 122.386 0.275 . . . . 0.0 110.715 -178.702 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -64.65 -49.32 71.47 Favored 'General case' 0 C--O 1.227 -0.125 0 N-CA-C 109.521 -0.548 . . . . 0.0 109.521 179.447 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.38 -31.76 73.1 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.258 179.844 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -71.41 -53.22 14.79 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 122.241 0.216 . . . . 0.0 110.635 -178.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 42.7 t30 -147.94 -82.65 0.12 Allowed 'General case' 0 C--N 1.342 0.264 0 CA-C-O 119.682 -0.199 . . . . 0.0 111.06 -177.851 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 95.2 t -140.68 -66.87 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.348 0.514 0 CA-C-N 117.68 0.218 . . . . 0.0 110.911 -176.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 74.4 m -132.43 172.48 12.42 Favored 'General case' 0 C--N 1.344 0.365 0 CA-C-O 120.995 0.426 . . . . 0.0 110.892 -176.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 43.0 p -53.91 -31.72 51.04 Favored 'General case' 0 C--O 1.223 -0.314 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.438 -178.696 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 12.8 t -49.4 -44.8 45.45 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 122.099 0.159 . . . . 0.0 110.936 -178.992 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 6.6 m -57.52 -28.83 63.82 Favored 'General case' 0 C--N 1.342 0.281 0 CA-C-O 119.687 -0.197 . . . . 0.0 111.116 -178.756 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 40.2 t -88.33 -37.08 9.99 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.223 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 179.098 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 25.4 m -57.08 -45.86 82.97 Favored 'General case' 0 CA--C 1.519 -0.233 0 C-N-CA 122.474 0.31 . . . . 0.0 110.473 -177.347 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 52.9 m-70 -56.13 -43.16 77.93 Favored 'General case' 0 C--O 1.209 -1.064 0 N-CA-C 110.177 -0.305 . . . . 0.0 110.177 -179.497 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 3.2 t -58.27 -29.5 37.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 O-C-N 121.9 -0.5 . . . . 0.0 112.325 -176.204 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 2.7 mt -79.85 -29.41 12.89 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.462 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 -176.239 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 6.4 p30 -117.37 -33.7 4.54 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 118.613 0.642 . . . . 0.0 112.168 -175.488 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 174.08 102.9 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 -177.521 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 65.5 p -48.83 -33.34 10.32 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 112.722 0.638 . . . . 0.0 112.722 -177.609 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 74.68 -164.0 0.08 Allowed 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 -177.148 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.1 t80 -79.24 96.14 5.84 Favored 'General case' 0 CA--C 1.531 0.232 0 O-C-N 122.249 -0.282 . . . . 0.0 110.779 -178.209 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 1.6 m -149.22 151.21 13.2 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.236 0 N-CA-C 108.576 -0.898 . . . . 0.0 108.576 176.9 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.88 153.66 42.99 Favored 'General case' 0 N--CA 1.447 -0.605 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 178.855 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 38.3 mp0 -55.21 -34.09 63.64 Favored 'General case' 0 CA--C 1.527 0.088 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 179.589 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -53.84 -41.84 67.84 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 122.66 0.384 . . . . 0.0 110.804 -179.857 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 1.7 m -66.22 -22.73 66.35 Favored 'General case' 0 C--N 1.346 0.432 0 N-CA-C 110.234 -0.284 . . . . 0.0 110.234 -178.202 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 3.0 mmp_? -85.07 -47.03 10.59 Favored 'General case' 0 C--N 1.343 0.312 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 179.762 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 28.2 m120 -54.19 -43.66 70.91 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 179.51 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -58.02 -41.61 83.51 Favored 'General case' 0 N--CA 1.453 -0.307 0 O-C-N 123.165 0.291 . . . . 0.0 111.317 -179.523 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 38.4 t -66.16 -57.17 11.5 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.195 0 CA-C-N 117.609 0.186 . . . . 0.0 110.551 -177.919 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 33.9 m95 -65.45 -30.77 71.6 Favored 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 110.719 -0.104 . . . . 0.0 110.719 -177.315 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -67.24 -51.12 57.05 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 177.505 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.23 -41.55 84.36 Favored 'General case' 0 C--N 1.342 0.266 0 C-N-CA 122.362 0.265 . . . . 0.0 110.334 179.74 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 3.2 mm -54.39 -50.82 54.53 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.272 0 C-N-CA 122.788 0.435 . . . . 0.0 110.315 179.782 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 20.4 tptm -74.11 -33.16 63.49 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 110.243 -0.28 . . . . 0.0 110.243 -178.014 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -63.96 -63.35 1.18 Allowed 'General case' 0 N--CA 1.448 -0.539 0 C-N-CA 122.368 0.267 . . . . 0.0 110.947 -177.61 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 82.3 mt -83.49 -20.79 33.32 Favored 'General case' 0 C--N 1.338 0.088 0 CA-C-O 119.47 -0.3 . . . . 0.0 111.503 -176.768 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 73.87 138.47 0.06 Allowed 'General case' 0 C--N 1.345 0.407 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 -178.279 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 8.7 t80 . . . . . 0 C--N 1.333 -0.126 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 179.487 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 33.9 pt . . . . . 0 N--CA 1.443 -0.776 0 N-CA-C 109.673 -0.491 . . . . 0.0 109.673 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 36.5 mtpt -65.71 -63.11 1.17 Allowed 'General case' 0 N--CA 1.448 -0.536 0 N-CA-C 109.549 -0.537 . . . . 0.0 109.549 179.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -49.41 -49.83 43.19 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.447 178.843 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 64.4 t -58.78 -51.75 68.33 Favored 'Isoleucine or valine' 0 C--N 1.341 0.224 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.299 -179.239 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -55.6 -54.56 42.62 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 122.28 0.232 . . . . 0.0 110.64 -178.726 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 61.9 mtpt -58.83 -38.85 79.61 Favored 'General case' 0 N--CA 1.453 -0.283 0 O-C-N 123.113 0.258 . . . . 0.0 110.457 -178.371 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 14.1 tpt180 -63.41 -36.82 84.98 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 177.701 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -82.75 7.86 13.83 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 122.417 0.287 . . . . 0.0 110.241 177.862 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 76.53 -35.79 0.25 Allowed 'General case' 0 C--N 1.35 0.591 0 C-N-CA 124.144 0.977 . . . . 0.0 111.888 177.823 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.416 HG23 ' H ' ' A' ' 13' ' ' VAL . 0.0 OUTLIER -78.05 -170.99 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 CA-C-N 118.321 0.509 . . . . 0.0 110.384 -178.003 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 11.2 t -102.93 179.78 4.18 Favored 'General case' 0 C--N 1.345 0.372 0 C-N-CA 122.824 0.45 . . . . 0.0 110.439 -178.468 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 19.4 p -58.02 -29.21 65.14 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 123.106 0.562 . . . . 0.0 111.644 -177.372 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 12.5 t -53.91 -38.23 64.62 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 117.814 0.279 . . . . 0.0 110.667 -179.298 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . 0.522 ' O ' HG23 ' A' ' 21' ' ' VAL . 87.2 m -67.4 -36.68 81.78 Favored 'General case' 0 N--CA 1.451 -0.393 0 O-C-N 122.168 -0.332 . . . . 0.0 110.152 -179.361 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 66.7 t -73.96 -41.02 53.0 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 N-CA-C 109.931 -0.396 . . . . 0.0 109.931 -179.62 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 94.0 p -59.88 -41.31 91.28 Favored 'General case' 0 N--CA 1.453 -0.278 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 179.021 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 55.2 m170 -56.5 -35.45 68.03 Favored 'General case' 0 C--N 1.346 0.436 0 N-CA-C 110.085 -0.339 . . . . 0.0 110.085 177.827 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.549 HG22 ' HD2' ' A' ' 33' ' ' ARG . 99.4 t -72.94 -57.79 6.27 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.162 0 C-N-CA 122.376 0.27 . . . . 0.0 110.68 -177.714 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 34.2 mm -57.0 -48.46 81.69 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.157 0 N-CA-C 110.368 -0.234 . . . . 0.0 110.368 -177.509 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 34.9 m-80 -73.8 -28.86 61.85 Favored 'General case' 0 CA--C 1.53 0.192 0 N-CA-C 110.496 -0.187 . . . . 0.0 110.496 -179.27 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 34.3 ttpt 57.01 53.72 7.72 Favored 'General case' 0 C--N 1.344 0.327 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 -179.124 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 13.9 t -108.46 -43.3 4.35 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.849 -177.432 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 27.0 tpt180 -85.54 109.66 18.67 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 109.408 -0.59 . . . . 0.0 109.408 -179.013 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 66.4 t80 -64.64 144.68 57.05 Favored 'General case' 0 N--CA 1.456 -0.149 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.268 -179.802 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 5.5 m -147.81 -171.05 0.25 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 -179.567 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -85.53 28.89 0.72 Allowed 'General case' 0 CA--C 1.539 0.526 0 CA-C-O 119.621 -0.228 . . . . 0.0 111.322 -179.325 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 72.56 -65.64 0.34 Allowed 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 123.427 0.691 . . . . 0.0 111.564 178.086 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -42.76 -47.13 5.39 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.355 0.662 . . . . 0.0 111.599 -176.872 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 6.6 m -50.48 -39.95 49.62 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 122.426 0.29 . . . . 0.0 111.026 -179.195 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.549 ' HD2' HG22 ' A' ' 21' ' ' VAL . 3.4 mpt_? -82.38 -42.45 18.64 Favored 'General case' 0 N--CA 1.46 0.058 0 N-CA-C 109.992 -0.373 . . . . 0.0 109.992 -178.789 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 20.2 t30 -54.41 -43.45 71.5 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 110.014 -0.365 . . . . 0.0 110.014 179.364 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -56.98 -49.0 77.09 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 122.537 0.335 . . . . 0.0 110.272 179.858 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 84.8 t -62.85 -49.28 84.28 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 N-CA-C 109.824 -0.436 . . . . 0.0 109.824 179.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 18.4 m95 -53.84 -40.27 66.31 Favored 'General case' 0 C--N 1.341 0.236 0 N-CA-C 110.05 -0.352 . . . . 0.0 110.05 179.767 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -66.55 -47.59 72.36 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 178.41 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -53.75 -39.57 65.45 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 122.425 0.29 . . . . 0.0 110.974 -179.482 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 1.1 mp -53.69 -39.75 39.84 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.384 0 N-CA-C 110.231 -0.285 . . . . 0.0 110.231 179.792 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 57.4 tptt -86.71 -40.25 15.23 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 122.244 0.218 . . . . 0.0 110.744 -177.328 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 47.2 mm-40 -61.68 -51.8 66.94 Favored 'General case' 0 N--CA 1.456 -0.175 0 N-CA-C 110.04 -0.355 . . . . 0.0 110.04 -177.696 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 61.3 tp -83.78 -82.54 0.16 Allowed 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 179.571 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 2.5 p-80 161.8 145.31 0.01 OUTLIER 'General case' 0 C--N 1.345 0.372 0 C-N-CA 124.24 1.016 . . . . 0.0 108.589 -179.835 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 29.5 t80 . . . . . 0 C--N 1.329 -0.294 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 178.887 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 20.2 tt . . . . . 0 C--O 1.223 -0.304 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 9.0 mtmp? -59.75 -65.84 0.61 Allowed 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 122.575 0.35 . . . . 0.0 110.125 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -54.96 -51.3 66.61 Favored 'General case' 0 N--CA 1.456 -0.147 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.513 -178.698 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 55.0 t -55.99 -49.86 72.92 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 C-N-CA 122.658 0.383 . . . . 0.0 110.643 -178.196 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.0 -50.47 70.61 Favored 'General case' 0 N--CA 1.456 -0.168 0 C-N-CA 122.175 0.19 . . . . 0.0 111.186 -177.743 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 41.9 tttm -62.08 -36.03 80.46 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 122.071 0.149 . . . . 0.0 110.624 -178.024 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 21.7 tpp180 -72.44 -41.25 66.36 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 109.754 -0.462 . . . . 0.0 109.754 179.588 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -64.89 -57.42 8.85 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 122.541 0.337 . . . . 0.0 111.129 -178.384 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 22.1 m120 -135.74 -121.36 0.16 Allowed 'General case' 0 C--N 1.342 0.253 0 N-CA-C 110.299 -0.26 . . . . 0.0 110.299 -177.22 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 94.5 t -87.69 -58.8 3.17 Favored 'Isoleucine or valine' 0 C--N 1.342 0.266 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 -178.351 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 52.4 p -167.48 -164.04 0.56 Allowed 'General case' 0 C--O 1.232 0.155 0 N-CA-C 109.912 -0.403 . . . . 0.0 109.912 -179.06 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 27.9 m -56.88 -27.39 60.45 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.557 179.914 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 23.5 p -59.79 -54.56 44.81 Favored 'General case' 0 C--N 1.341 0.236 0 N-CA-C 110.068 -0.345 . . . . 0.0 110.068 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -62.57 -20.91 65.17 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-O 119.52 -0.276 . . . . 0.0 111.084 -179.337 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 39.4 t -82.04 -53.27 12.29 Favored 'Isoleucine or valine' 0 C--N 1.34 0.178 0 CA-C-N 118.028 0.377 . . . . 0.0 110.035 179.272 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 84.2 p -50.87 -38.42 49.35 Favored 'General case' 0 C--N 1.342 0.268 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 -179.325 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 58.1 m170 -50.22 -39.82 45.58 Favored 'General case' 0 CA--C 1.529 0.166 0 O-C-N 123.266 0.353 . . . . 0.0 110.227 178.344 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 3.7 t -84.81 -53.97 9.65 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.167 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.032 -178.679 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 31.6 mm -55.22 -50.33 65.25 Favored 'Isoleucine or valine' 0 C--N 1.343 0.307 0 O-C-N 122.797 0.061 . . . . 0.0 110.918 -175.788 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 25.5 t30 -82.42 -3.2 55.21 Favored 'General case' 0 CA--C 1.533 0.305 0 N-CA-C 110.175 -0.306 . . . . 0.0 110.175 -178.498 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 52.8 mtmt 55.19 37.82 29.48 Favored 'General case' 0 C--N 1.347 0.466 0 N-CA-C 108.839 -0.801 . . . . 0.0 108.839 -178.294 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.9 -32.47 73.74 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 115.567 -0.742 . . . . 0.0 109.885 -178.877 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 15.6 ptp180 -157.48 145.05 18.69 Favored 'General case' 0 N--CA 1.452 -0.362 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 179.007 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 30.8 t80 -79.66 92.12 5.33 Favored 'General case' 0 N--CA 1.455 -0.214 0 N-CA-C 109.752 -0.462 . . . . 0.0 109.752 -178.812 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 11.7 m -72.75 163.58 3.88 Favored 'Isoleucine or valine' 0 C--O 1.233 0.22 0 N-CA-C 109.92 -0.4 . . . . 0.0 109.92 178.845 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -65.35 157.03 30.32 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 178.142 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -53.92 -38.02 64.42 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 122.575 0.35 . . . . 0.0 110.415 -179.946 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -68.14 -12.4 60.84 Favored 'General case' 0 CA--C 1.538 0.518 0 N-CA-C 112.172 0.434 . . . . 0.0 112.172 -177.432 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -94.67 -52.31 4.34 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 118.343 0.52 . . . . 0.0 109.9 179.546 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 6.6 ptm180 -69.45 -35.28 75.49 Favored 'General case' 0 CA--C 1.53 0.2 0 N-CA-C 112.02 0.378 . . . . 0.0 112.02 -176.645 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 43.2 p-10 -57.59 -38.62 75.2 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 118.202 0.456 . . . . 0.0 110.162 -179.214 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.41 -43.09 91.64 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 110.32 -0.252 . . . . 0.0 110.32 -179.86 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 87.4 t -60.51 -59.66 3.81 Favored 'Isoleucine or valine' 0 C--N 1.339 0.15 0 N-CA-C 110.105 -0.332 . . . . 0.0 110.105 -179.466 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 52.5 m95 -60.47 -37.28 80.52 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 116.718 -0.219 . . . . 0.0 110.942 -177.549 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -63.49 -58.2 7.77 Favored 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 178.895 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -52.39 -45.17 65.71 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 122.304 0.242 . . . . 0.0 110.766 -178.745 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 36.1 mt -54.7 -30.13 21.98 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 C-N-CA 122.245 0.218 . . . . 0.0 111.041 -179.437 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 7.7 mtpm? -85.11 -53.61 5.16 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 110.047 -0.353 . . . . 0.0 110.047 -178.676 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -63.98 -55.86 19.32 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.657 -175.425 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -73.87 -3.23 27.56 Favored 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 179.556 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 37.0 p-80 40.62 84.18 0.02 OUTLIER 'General case' 0 C--N 1.353 0.741 0 C-N-CA 124.036 0.934 . . . . 0.0 111.556 179.291 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 13.3 t80 . . . . . 0 N--CA 1.456 -0.154 0 CA-C-N 115.527 -0.76 . . . . 0.0 109.166 178.963 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 19.5 tt . . . . . 0 N--CA 1.462 0.174 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 26.7 mmtp -67.35 -62.96 1.17 Allowed 'General case' 0 N--CA 1.445 -0.69 0 C-N-CA 122.785 0.434 . . . . 0.0 110.962 -179.425 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 65.7 m-20 -69.04 -42.83 75.82 Favored 'General case' 0 N--CA 1.461 0.105 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.798 -175.764 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.522 HG23 ' H ' ' A' ' 8' ' ' ALA . 18.7 m -53.31 -56.6 7.55 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.191 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 -179.905 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.522 ' H ' HG23 ' A' ' 7' ' ' VAL . . . -59.12 -45.88 89.78 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 122.988 0.515 . . . . 0.0 110.857 179.419 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 2.0 ttmp? -53.57 -49.74 67.05 Favored 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 110.178 -0.305 . . . . 0.0 110.178 -179.101 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 57.6 ttt85 -71.67 -37.81 70.72 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 122.371 0.268 . . . . 0.0 110.645 -179.007 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -60.53 -40.17 90.55 Favored 'General case' 0 N--CA 1.456 -0.168 0 C-N-CA 122.257 0.223 . . . . 0.0 110.793 -178.595 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 23.8 t-20 -140.79 -88.36 0.17 Allowed 'General case' 0 C--N 1.343 0.325 0 N-CA-C 110.461 -0.2 . . . . 0.0 110.461 -179.418 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 71.5 t -139.47 -57.35 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.345 0.38 0 N-CA-C 109.835 -0.432 . . . . 0.0 109.835 -178.266 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 67.1 m -152.44 176.34 11.77 Favored 'General case' 0 C--N 1.344 0.339 0 N-CA-C 109.872 -0.418 . . . . 0.0 109.872 -179.342 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 17.2 p -63.52 -20.59 65.74 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.103 -179.637 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 14.9 t -53.79 -38.82 64.89 Favored 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 109.999 -0.371 . . . . 0.0 109.999 179.601 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 18.0 m -61.47 -42.47 98.83 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 109.819 -0.438 . . . . 0.0 109.819 179.463 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 20.6 t -65.72 -35.63 75.65 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.14 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 179.356 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 23.1 t -65.28 -43.59 90.69 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 72.7 m-70 -64.16 -43.22 95.85 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.285 179.38 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 16.2 t -55.72 -47.17 79.58 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.28 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 179.123 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 60.3 mt -61.63 -48.46 88.66 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 29.4 m-80 -75.28 -9.97 59.04 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 122.167 0.187 . . . . 0.0 111.119 -179.245 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 4.8 tmtp? 62.38 42.97 8.51 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 122.893 0.477 . . . . 0.0 110.012 -179.881 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -98.24 -84.4 0.39 Allowed 'General case' 0 C--N 1.344 0.357 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 179.762 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 67.1 mtp180 -97.11 120.5 37.58 Favored 'General case' 0 N--CA 1.456 -0.126 0 N-CA-C 109.496 -0.557 . . . . 0.0 109.496 -179.792 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 29.2 p90 -149.77 120.78 7.7 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 179.234 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 3.8 t -81.76 75.97 0.96 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.396 0 N-CA-C 107.856 -1.164 . . . . 0.0 107.856 179.048 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 65.11 -178.89 0.18 Allowed 'General case' 0 C--O 1.236 0.348 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.094 -178.352 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 -65.29 -25.1 67.49 Favored 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 110.214 -0.291 . . . . 0.0 110.214 -179.197 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -52.09 -39.13 59.31 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 122.565 0.346 . . . . 0.0 110.813 179.438 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 99.0 m -59.07 -67.41 0.37 Allowed 'General case' 0 C--N 1.343 0.287 0 N-CA-C 110.439 -0.208 . . . . 0.0 110.439 -179.581 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 9.9 ptm180 -56.5 -39.13 72.77 Favored 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 110.581 -0.155 . . . . 0.0 110.581 -177.836 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -59.7 -57.39 13.12 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 110.305 -0.257 . . . . 0.0 110.305 -179.443 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -59.81 -42.25 93.06 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 122.429 0.292 . . . . 0.0 110.649 -179.102 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 21.3 t -58.39 -61.13 1.5 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.2 0 C-N-CA 122.365 0.266 . . . . 0.0 110.324 -179.216 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 19.5 m95 -61.63 -38.22 86.86 Favored 'General case' 0 N--CA 1.455 -0.177 0 N-CA-C 110.687 -0.116 . . . . 0.0 110.687 -178.145 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -59.65 -51.42 69.89 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 109.863 -0.421 . . . . 0.0 109.863 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -61.38 -46.94 88.1 Favored 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 122.29 0.236 . . . . 0.0 110.64 -179.38 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 55.5 mt -58.18 -41.83 81.82 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.295 0 C-N-CA 122.229 0.211 . . . . 0.0 110.496 -179.22 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 37.6 ttmt -74.2 -38.81 63.5 Favored 'General case' 0 N--CA 1.45 -0.449 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 -178.067 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -62.66 -52.83 61.78 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-N 116.564 -0.289 . . . . 0.0 110.455 -178.153 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 10.2 mp -79.24 -18.16 53.38 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-O 119.554 -0.26 . . . . 0.0 110.47 -179.061 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 22.2 m80 76.17 137.62 0.06 Allowed 'General case' 0 C--N 1.348 0.509 0 C-N-CA 123.871 0.868 . . . . 0.0 110.966 178.299 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 8.1 t80 . . . . . 0 CA--C 1.529 0.158 0 N-CA-C 108.466 -0.939 . . . . 0.0 108.466 178.729 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 7.1 tt . . . . . 0 CA--C 1.547 0.85 0 N-CA-C 111.836 0.31 . . . . 0.0 111.836 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 15.6 tppt? -48.01 -70.26 0.1 Allowed 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 123.552 0.741 . . . . 0.0 112.293 -178.11 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 69.1 m-20 -63.07 -40.19 96.95 Favored 'General case' 0 C--O 1.221 -0.399 0 CA-C-O 119.787 -0.149 . . . . 0.0 110.711 -175.579 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.431 HG23 ' CD2' ' A' ' 45' ' ' TYR . 2.4 t -52.17 -46.35 43.86 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.175 0 C-N-CA 122.166 0.187 . . . . 0.0 110.785 -179.111 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -52.61 -61.36 2.33 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 110.584 -0.154 . . . . 0.0 110.584 -178.578 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -68.38 -28.21 66.91 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-O 119.791 -0.147 . . . . 0.0 111.347 -177.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 1.6 tpm_? -62.01 -48.0 82.23 Favored 'General case' 0 C--N 1.339 0.146 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 179.212 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -78.49 -1.07 32.01 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 110.068 -0.345 . . . . 0.0 110.068 178.033 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 7.7 t-20 61.13 48.06 6.67 Favored 'General case' 0 C--N 1.348 0.501 0 C-N-CA 123.613 0.765 . . . . 0.0 110.828 178.8 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 30.3 m -146.43 148.01 17.45 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.221 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 177.671 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 69.2 m -63.91 154.76 32.85 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 109.762 -0.459 . . . . 0.0 109.762 179.604 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 15.0 t -53.81 -32.72 53.76 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 116.576 -0.283 . . . . 0.0 110.364 179.484 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 3.7 m -57.07 -43.0 81.66 Favored 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 178.891 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 6.1 m -63.06 -40.79 98.72 Favored 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 179.527 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 47.1 t -64.05 -39.05 84.07 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.238 0 N-CA-C 109.333 -0.618 . . . . 0.0 109.333 179.417 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 10.0 t -55.99 -37.64 69.38 Favored 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 110.129 -0.323 . . . . 0.0 110.129 179.337 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 43.0 m170 -61.27 -33.61 73.83 Favored 'General case' 0 C--N 1.341 0.237 0 N-CA-C 110.261 -0.274 . . . . 0.0 110.261 179.704 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 90.8 t -74.56 -41.41 48.8 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.099 0 C-N-CA 122.182 0.193 . . . . 0.0 110.886 -178.969 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 72.4 mt -49.23 -55.05 4.52 Favored 'Isoleucine or valine' 0 C--N 1.343 0.298 0 C-N-CA 122.297 0.239 . . . . 0.0 110.958 -176.828 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 5.8 p30 -104.8 13.31 31.51 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 117.558 0.163 . . . . 0.0 110.825 -178.36 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 65.1 mttt 46.9 58.57 4.63 Favored 'General case' 0 C--N 1.346 0.421 0 C-N-CA 122.829 0.452 . . . . 0.0 110.64 179.268 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -72.49 -65.98 0.72 Allowed 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 -179.528 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 84.1 mtt85 -94.04 129.06 40.7 Favored 'General case' 0 C--N 1.342 0.274 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 -179.608 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -77.14 111.12 12.41 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 109.37 -0.604 . . . . 0.0 109.37 179.942 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 9.5 m -110.03 43.31 0.27 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 CA-C-N 115.806 -0.633 . . . . 0.0 109.479 -178.881 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.416 ' C ' ' H ' ' A' ' 31' ' ' GLU . . . 54.79 22.69 4.34 Favored 'General case' 0 C--N 1.345 0.379 0 C-N-CA 123.565 0.746 . . . . 0.0 112.16 178.52 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 70.6 mm-40 65.82 -26.65 0.1 Allowed 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 124.052 0.941 . . . . 0.0 113.096 178.661 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.416 ' H ' ' C ' ' A' ' 29' ' ' ALA . 40.8 tt0 -48.11 -58.93 3.82 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 118.547 0.612 . . . . 0.0 110.879 -178.528 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 7.9 m -64.64 -39.63 94.03 Favored 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 110.744 -0.095 . . . . 0.0 110.744 -178.512 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 92.2 mtt180 -57.97 -52.89 63.63 Favored 'General case' 0 CA--C 1.533 0.299 0 N-CA-C 110.129 -0.323 . . . . 0.0 110.129 -179.327 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -63.72 -37.95 89.27 Favored 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 110.066 -0.346 . . . . 0.0 110.066 -179.232 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -60.63 -42.54 97.11 Favored 'General case' 0 C--N 1.341 0.205 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 179.051 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 20.6 t -65.59 -45.08 93.39 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 179.014 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 15.4 m95 -61.63 -33.75 74.47 Favored 'General case' 0 CA--C 1.531 0.244 0 N-CA-C 109.895 -0.409 . . . . 0.0 109.895 179.145 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -67.58 -42.96 81.7 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 109.033 -0.728 . . . . 0.0 109.033 177.365 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.64 -38.67 78.61 Favored 'General case' 0 C--N 1.345 0.393 0 N-CA-C 110.001 -0.37 . . . . 0.0 110.001 178.884 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -54.65 -44.88 71.65 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 179.367 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 15.0 mttm -94.99 12.55 28.05 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-O 119.655 -0.212 . . . . 0.0 111.313 -178.467 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -79.32 -48.86 13.36 Favored 'General case' 0 N--CA 1.456 -0.168 0 N-CA-C 108.647 -0.872 . . . . 0.0 108.647 178.917 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -92.99 -94.03 0.15 Allowed 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 178.709 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 99.7 m-70 -159.79 26.41 0.18 Allowed 'General case' 0 C--N 1.343 0.286 0 C-N-CA 123.232 0.613 . . . . 0.0 109.533 -178.322 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.431 ' CD2' HG23 ' A' ' 7' ' ' VAL . 2.5 m-85 . . . . . 0 C--N 1.332 -0.186 0 CA-C-O 120.989 0.423 . . . . 0.0 110.036 -177.931 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.468 0.465 0 N-CA-C 110.429 -0.212 . . . . 0.0 110.429 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -66.97 -66.03 0.61 Allowed 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 122.568 0.347 . . . . 0.0 110.252 -179.812 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 91.3 m-20 -65.55 -39.0 91.23 Favored 'General case' 0 C--O 1.227 -0.084 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 84.7 t -55.52 -44.25 75.57 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.235 0 C-N-CA 122.673 0.389 . . . . 0.0 110.176 -179.487 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -57.6 -47.07 83.16 Favored 'General case' 0 C--N 1.34 0.187 0 C-N-CA 122.044 0.137 . . . . 0.0 110.707 -179.294 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 6.3 mmmm -67.09 -41.12 86.84 Favored 'General case' 0 N--CA 1.457 -0.089 0 N-CA-C 109.773 -0.454 . . . . 0.0 109.773 179.912 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 45.0 ttt85 -59.52 -35.79 74.86 Favored 'General case' 0 N--CA 1.452 -0.351 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 179.131 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -75.89 -56.93 4.2 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 110.029 -0.359 . . . . 0.0 110.029 179.556 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -164.15 -93.73 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 119.82 -0.133 . . . . 0.0 111.276 -179.151 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 5.0 m -97.94 -118.63 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 C-N-CA 122.232 0.213 . . . . 0.0 110.867 -176.248 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 89.5 p -105.98 -175.09 2.7 Favored 'General case' 0 C--N 1.344 0.36 0 C-N-CA 122.621 0.368 . . . . 0.0 110.327 -176.981 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 76.8 p -55.83 -23.83 32.81 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.215 -178.398 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.4 HG23 ' N ' ' A' ' 17' ' ' THR . 13.2 t -51.62 -44.83 63.05 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 117.724 0.238 . . . . 0.0 110.426 -179.898 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . 0.4 ' N ' HG23 ' A' ' 16' ' ' THR . 2.4 m -64.92 -47.91 76.04 Favored 'General case' 0 C--N 1.341 0.219 0 N-CA-C 110.301 -0.259 . . . . 0.0 110.301 -179.453 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 54.6 t -58.4 -44.84 89.52 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.169 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 -179.47 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 56.3 m -60.91 -45.81 93.18 Favored 'General case' 0 C--O 1.22 -0.496 0 N-CA-C 110.013 -0.365 . . . . 0.0 110.013 179.489 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 34.7 m170 -58.31 -41.58 84.78 Favored 'General case' 0 C--N 1.339 0.148 0 N-CA-C 110.292 -0.262 . . . . 0.0 110.292 -179.608 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 42.4 t -65.88 -55.93 17.17 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.257 0 O-C-N 123.085 0.241 . . . . 0.0 110.688 -178.939 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 92.6 mt -64.02 -53.34 45.12 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 N-CA-C 110.299 -0.26 . . . . 0.0 110.299 -177.69 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 19.4 t-20 -62.32 -30.66 71.31 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 122.624 0.37 . . . . 0.0 110.581 -179.237 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 41.2 tttp 71.45 53.09 0.23 Allowed 'General case' 0 C--N 1.344 0.342 0 C-N-CA 122.915 0.486 . . . . 0.0 109.735 179.816 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 26.6 p -75.71 -64.57 1.05 Allowed 'General case' 0 C--N 1.34 0.154 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 179.39 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 48.6 ttp85 -128.89 134.23 48.2 Favored 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 179.629 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 54.6 p90 -64.85 143.19 58.11 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 179.749 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 30.1 m -110.27 170.42 3.28 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.147 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 179.529 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -80.3 51.35 1.4 Allowed 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 122.402 0.281 . . . . 0.0 111.213 -177.728 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 63.79 -68.68 0.09 Allowed 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.249 1.02 . . . . 0.0 112.746 177.835 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 56.5 mm-40 -37.4 -53.5 1.12 Allowed 'General case' 0 C--N 1.34 0.162 0 C-N-CA 123.729 0.812 . . . . 0.0 112.076 -175.042 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 8.2 m -60.05 -52.04 67.07 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 116.983 -0.098 . . . . 0.0 111.015 -177.47 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 11.8 ttp85 -60.89 -47.47 86.24 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 122.26 0.224 . . . . 0.0 110.64 -178.58 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 20.5 m-80 -61.69 -41.18 97.22 Favored 'General case' 0 N--CA 1.456 -0.158 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 -179.788 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -60.79 -40.62 93.3 Favored 'General case' 0 C--N 1.34 0.185 0 N-CA-C 110.158 -0.312 . . . . 0.0 110.158 179.852 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 38.0 t -64.09 -53.79 39.39 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.199 0 N-CA-C 109.6 -0.518 . . . . 0.0 109.6 179.439 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 13.5 m95 -59.82 -33.92 72.39 Favored 'General case' 0 C--O 1.233 0.229 0 N-CA-C 110.615 -0.143 . . . . 0.0 110.615 -179.202 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -70.37 -57.85 4.38 Favored 'General case' 0 C--O 1.224 -0.286 0 N-CA-C 109.789 -0.449 . . . . 0.0 109.789 179.401 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -50.09 -44.19 51.81 Favored 'General case' 0 C--N 1.341 0.203 0 C-N-CA 122.94 0.496 . . . . 0.0 111.066 -179.082 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 13.8 mt -51.36 -40.92 24.62 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 C-N-CA 122.977 0.511 . . . . 0.0 111.046 -179.36 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 41.2 mttp -98.03 -20.0 17.66 Favored 'General case' 0 C--N 1.344 0.328 0 N-CA-C 111.567 0.21 . . . . 0.0 111.567 -177.13 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -73.17 -50.04 24.8 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 109.106 -0.702 . . . . 0.0 109.106 -178.089 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 51.6 tp -77.64 -92.0 0.03 OUTLIER 'General case' 0 N--CA 1.446 -0.642 0 N-CA-C 108.153 -1.054 . . . . 0.0 108.153 177.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 4.0 p-80 165.3 75.87 0.0 OUTLIER 'General case' 0 C--N 1.341 0.233 0 C-N-CA 123.759 0.824 . . . . 0.0 108.996 179.781 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 15.6 t80 . . . . . 0 C--N 1.325 -0.486 0 CA-C-N 116.118 -0.492 . . . . 0.0 109.776 -179.411 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.47 0.528 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 62.9 mttp -69.68 -60.97 1.98 Allowed 'General case' 0 N--CA 1.446 -0.64 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 177.586 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -63.91 -51.49 64.25 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 115.683 -0.69 . . . . 0.0 109.502 178.619 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 76.5 t -45.65 -47.1 4.79 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.225 0 C-N-CA 123.121 0.569 . . . . 0.0 111.707 -177.399 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -53.86 -62.46 1.64 Allowed 'General case' 0 C--O 1.223 -0.313 0 CA-C-N 117.511 0.142 . . . . 0.0 111.333 -177.78 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 21.7 mmmt -68.45 -44.11 75.6 Favored 'General case' 0 C--N 1.331 -0.232 0 O-C-N 122.45 -0.156 . . . . 0.0 110.988 -176.874 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 16.3 tpp180 -57.82 -39.82 78.52 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 122.568 0.347 . . . . 0.0 110.7 -178.467 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -98.22 12.86 33.26 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-O 119.562 -0.256 . . . . 0.0 110.825 -179.384 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . 0.912 ' O ' HG22 ' A' ' 13' ' ' VAL . 48.6 t30 75.52 150.83 0.12 Allowed 'General case' 0 C--N 1.35 0.589 0 C-N-CA 123.684 0.793 . . . . 0.0 110.147 179.945 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.912 HG22 ' O ' ' A' ' 12' ' ' ASN . 2.2 m 82.94 175.1 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.479 0.982 0 C-N-CA 125.679 1.591 . . . . 0.0 110.315 -179.609 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 22.4 t -96.91 -178.06 4.09 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.501 -177.623 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 19.1 p -69.0 -45.17 71.25 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.383 -179.048 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 11.9 t -56.22 -41.93 76.45 Favored 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 110.46 -0.2 . . . . 0.0 110.46 -179.121 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -65.3 -28.28 69.21 Favored 'General case' 0 CA--C 1.53 0.202 0 O-C-N 122.24 -0.287 . . . . 0.0 110.34 179.893 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 65.8 t -76.59 -37.89 30.21 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.199 0 N-CA-C 108.496 -0.927 . . . . 0.0 108.496 176.707 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 19.6 m -58.71 -33.08 69.79 Favored 'General case' 0 CA--C 1.531 0.226 0 N-CA-C 109.989 -0.374 . . . . 0.0 109.989 178.521 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 51.4 m170 -56.13 -39.35 72.1 Favored 'General case' 0 C--N 1.345 0.381 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 178.398 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 56.4 t -68.02 -46.36 81.87 Favored 'Isoleucine or valine' 0 C--N 1.341 0.211 0 N-CA-C 109.786 -0.45 . . . . 0.0 109.786 179.66 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 72.7 mt -58.87 -39.57 77.82 Favored 'Isoleucine or valine' 0 C--O 1.234 0.253 0 N-CA-C 109.835 -0.431 . . . . 0.0 109.835 -179.236 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 34.5 m-80 -93.77 15.35 16.67 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 122.369 0.267 . . . . 0.0 110.282 179.436 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 30.15 65.39 0.14 Allowed 'General case' 0 C--N 1.356 0.868 0 C-N-CA 124.376 1.07 . . . . 0.0 111.566 -179.357 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 17.4 p -104.44 -83.7 0.49 Allowed 'General case' 0 C--N 1.342 0.24 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 178.208 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 14.4 tpt180 -90.81 105.29 17.72 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 108.936 -0.764 . . . . 0.0 108.936 179.212 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 40.7 t80 -78.26 100.45 6.69 Favored 'General case' 0 N--CA 1.454 -0.227 0 N-CA-C 109.705 -0.48 . . . . 0.0 109.705 -179.738 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 4.3 t -87.28 57.4 0.17 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.42 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 -179.917 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 65.26 176.25 0.21 Allowed 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 123.233 0.613 . . . . 0.0 111.489 178.933 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 48.1 mp0 -68.9 -25.74 64.75 Favored 'General case' 0 C--O 1.219 -0.509 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.009 -179.273 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 20.6 tp10 -53.81 -60.26 3.55 Favored 'General case' 0 C--O 1.226 -0.165 0 C-N-CA 122.559 0.344 . . . . 0.0 111.263 -176.982 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 63.1 p -61.83 -44.75 96.21 Favored 'General case' 0 C--O 1.224 -0.272 0 N-CA-C 110.003 -0.369 . . . . 0.0 110.003 -178.555 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 64.7 ttp85 -56.37 -60.19 3.87 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 122.41 0.284 . . . . 0.0 111.284 -178.192 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -67.01 -39.91 87.17 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-O 119.603 -0.236 . . . . 0.0 111.08 -175.231 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -62.8 -45.13 94.06 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 117.881 0.309 . . . . 0.0 110.409 -179.777 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 20.3 t -60.63 -57.25 12.82 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.108 0 C-N-CA 122.299 0.24 . . . . 0.0 110.646 -178.802 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 14.9 m95 -60.14 -38.04 81.89 Favored 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 110.77 -0.085 . . . . 0.0 110.77 -178.151 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -63.25 -53.23 56.28 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 -179.933 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -60.3 -40.49 90.72 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-N 116.569 -0.287 . . . . 0.0 110.636 -179.139 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 14.3 mt -59.53 -44.53 93.27 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.146 0 N-CA-C 110.232 -0.284 . . . . 0.0 110.232 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 57.8 tptt -70.27 -35.28 73.65 Favored 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 -178.59 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -66.74 -52.87 39.27 Favored 'General case' 0 N--CA 1.443 -0.798 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.041 -177.98 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 10.5 mp -81.78 -21.05 38.0 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 122.348 0.259 . . . . 0.0 111.305 -177.456 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 2.4 m-70 71.73 110.66 0.06 Allowed 'General case' 0 N--CA 1.465 0.317 0 N-CA-C 108.636 -0.876 . . . . 0.0 108.636 -177.032 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 1.3 t80 . . . . . 0 C--N 1.325 -0.474 0 C-N-CA 122.83 0.452 . . . . 0.0 110.387 -176.522 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 14.8 tt . . . . . 0 N--CA 1.465 0.317 0 N-CA-C 109.802 -0.444 . . . . 0.0 109.802 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 22.3 mtmm -48.33 -68.55 0.17 Allowed 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 123.657 0.783 . . . . 0.0 111.849 -177.587 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -52.23 -58.46 6.57 Favored 'General case' 0 C--O 1.219 -0.504 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.073 -177.667 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 63.1 t -50.22 -42.4 20.17 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.398 0 O-C-N 123.001 0.188 . . . . 0.0 111.197 -176.434 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -53.38 -62.86 1.38 Allowed 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 112.019 0.377 . . . . 0.0 112.019 -177.024 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 19.0 mtpp -79.1 -38.33 36.47 Favored 'General case' 0 N--CA 1.461 0.12 0 N-CA-C 110.618 -0.142 . . . . 0.0 110.618 -176.088 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 57.5 ttm-85 -57.6 -35.26 70.2 Favored 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 179.197 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -76.36 -60.82 2.17 Favored 'General case' 0 C--N 1.347 0.463 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 177.288 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 179.99 131.0 0.1 Allowed 'General case' 0 C--N 1.347 0.461 0 CA-C-O 120.686 0.279 . . . . 0.0 111.295 179.641 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 37.8 t 52.18 -94.52 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 C-N-CA 123.788 0.835 . . . . 0.0 111.497 176.31 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 66.9 m -149.96 -178.31 6.41 Favored 'General case' 0 C--N 1.344 0.364 0 CA-C-O 120.777 0.322 . . . . 0.0 110.368 -177.479 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 10.0 m -53.2 -35.26 59.68 Favored 'General case' 0 C--O 1.224 -0.259 0 C-N-CA 123.161 0.585 . . . . 0.0 110.975 -178.803 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 17.1 p -51.71 -46.86 64.1 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 122.46 0.304 . . . . 0.0 110.425 -179.29 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 24.9 m -65.62 -48.42 72.3 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 110.327 -0.249 . . . . 0.0 110.327 -178.907 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 87.5 t -60.38 -35.1 60.46 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.35 0 N-CA-C 110.242 -0.281 . . . . 0.0 110.242 -179.439 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 7.7 t -59.48 -45.06 92.72 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 109.983 -0.377 . . . . 0.0 109.983 -179.609 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 80.6 m-70 -58.49 -40.11 81.87 Favored 'General case' 0 N--CA 1.456 -0.135 0 O-C-N 122.996 0.185 . . . . 0.0 110.695 -179.021 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 52.9 t -56.27 -52.7 48.44 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.153 0 N-CA-C 110.003 -0.369 . . . . 0.0 110.003 -179.599 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 78.4 mt -66.04 -42.5 91.7 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 -179.415 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 37.8 t-20 -66.02 -20.92 66.34 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 122.973 0.509 . . . . 0.0 110.608 -179.545 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 74.3 tttt 66.24 50.98 1.29 Allowed 'General case' 0 C--N 1.343 0.289 0 C-N-CA 122.952 0.501 . . . . 0.0 109.655 -179.607 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -97.95 -82.89 0.41 Allowed 'General case' 0 C--N 1.341 0.212 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 179.665 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 19.0 ptp180 -87.36 154.17 20.89 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 179.792 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 50.5 t80 -123.83 145.39 49.11 Favored 'General case' 0 N--CA 1.456 -0.151 0 N-CA-C 109.886 -0.413 . . . . 0.0 109.886 -179.729 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.481 HG12 ' H ' ' A' ' 29' ' ' ALA . 2.9 t -134.97 172.87 15.35 Favored 'Isoleucine or valine' 0 C--O 1.231 0.114 0 N-CA-C 107.828 -1.175 . . . . 0.0 107.828 179.198 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.481 ' H ' HG12 ' A' ' 28' ' ' VAL . . . -48.08 149.52 1.41 Allowed 'General case' 0 C--O 1.235 0.331 0 N-CA-C 110.142 -0.318 . . . . 0.0 110.142 179.051 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 22.2 mp0 -51.3 -28.37 11.89 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.681 -179.225 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -57.02 -47.91 79.74 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 122.216 0.206 . . . . 0.0 110.499 179.624 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 10.4 m -64.82 -49.7 69.58 Favored 'General case' 0 C--N 1.344 0.359 0 N-CA-C 110.189 -0.3 . . . . 0.0 110.189 -178.74 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 38.4 mmt-85 -55.84 -50.64 70.0 Favored 'General case' 0 N--CA 1.455 -0.206 0 N-CA-C 109.785 -0.45 . . . . 0.0 109.785 -179.557 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -59.0 -48.49 81.38 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 122.552 0.341 . . . . 0.0 110.379 -179.613 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -57.83 -45.2 86.53 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 122.121 0.168 . . . . 0.0 110.678 -178.934 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 54.6 t -60.28 -57.24 12.73 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 N-CA-C 110.243 -0.28 . . . . 0.0 110.243 -178.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 41.4 m95 -60.63 -40.26 91.25 Favored 'General case' 0 CA--C 1.53 0.183 0 N-CA-C 110.735 -0.098 . . . . 0.0 110.735 -178.434 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -60.29 -53.14 61.24 Favored 'General case' 0 N--CA 1.453 -0.278 0 N-CA-C 109.722 -0.473 . . . . 0.0 109.722 179.69 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -56.41 -45.19 80.79 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 122.316 0.246 . . . . 0.0 110.493 -179.632 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 31.1 mt -56.18 -36.9 47.34 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.472 0 C-N-CA 122.256 0.223 . . . . 0.0 110.694 -179.314 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 6.3 mptp? -80.23 -45.6 17.71 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 -178.587 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 24.1 mm-40 -58.29 -47.4 83.78 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 122.48 0.312 . . . . 0.0 110.964 -178.052 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 6.0 mp -80.67 -1.8 44.01 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-O 119.611 -0.233 . . . . 0.0 110.777 -178.691 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 4.7 m-70 60.05 32.0 20.84 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 122.873 0.469 . . . . 0.0 110.905 178.454 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 10.2 t80 . . . . . 0 C--N 1.33 -0.243 0 N-CA-C 109.438 -0.579 . . . . 0.0 109.438 179.237 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 19.8 tt . . . . . 0 C--O 1.225 -0.204 0 N-CA-C 110.149 -0.315 . . . . 0.0 110.149 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 45.0 mtpt -57.01 -60.14 4.03 Favored 'General case' 0 N--CA 1.446 -0.625 0 C-N-CA 122.699 0.399 . . . . 0.0 110.475 179.059 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -70.19 -42.64 72.12 Favored 'General case' 0 N--CA 1.458 -0.068 0 N-CA-C 110.168 -0.308 . . . . 0.0 110.168 -177.683 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 54.8 t -55.01 -47.74 76.58 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.166 0 N-CA-C 110.188 -0.301 . . . . 0.0 110.188 -179.408 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -58.16 -54.98 40.86 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 122.349 0.26 . . . . 0.0 110.864 -178.455 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 27.0 tttt -65.79 -27.39 68.24 Favored 'General case' 0 CA--C 1.531 0.247 0 O-C-N 122.808 0.068 . . . . 0.0 110.908 -177.931 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.95 -36.22 69.82 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 177.759 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -78.19 -41.59 34.1 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.264 -178.427 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -155.12 -147.67 0.21 Allowed 'General case' 0 N--CA 1.449 -0.504 0 CA-C-O 120.841 0.353 . . . . 0.0 110.727 -177.321 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 62.0 t -71.44 -54.39 17.43 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.501 0 C-N-CA 123.012 0.525 . . . . 0.0 110.336 -178.804 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 50.8 m -155.49 -179.05 7.73 Favored 'General case' 0 C--N 1.346 0.42 0 CA-C-O 121.007 0.432 . . . . 0.0 110.806 -177.806 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.8 m -66.98 -3.26 6.67 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.158 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 16.6 p -57.83 -56.09 26.48 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 179.132 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -60.29 -33.86 72.95 Favored 'General case' 0 CA--C 1.537 0.442 0 N-CA-C 110.265 -0.272 . . . . 0.0 110.265 -179.268 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 58.1 t -64.51 -46.74 91.82 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.222 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 179.269 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 20.6 m -60.26 -43.28 96.28 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 178.753 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 48.5 m170 -58.19 -43.3 87.48 Favored 'General case' 0 C--O 1.221 -0.414 0 N-CA-C 109.867 -0.419 . . . . 0.0 109.867 179.357 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 7.3 t -68.2 -39.61 81.46 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 C-N-CA 122.351 0.26 . . . . 0.0 111.155 -179.045 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 40.3 mt -60.04 -59.14 4.48 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.395 0 CA-C-O 119.424 -0.322 . . . . 0.0 111.789 -176.521 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 2.4 p-10 -114.14 22.12 14.13 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-N 118.235 0.47 . . . . 0.0 112.1 -175.644 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 29.6 ttpt 55.22 46.04 24.58 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 122.313 0.245 . . . . 0.0 110.774 177.96 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -66.93 -35.33 79.75 Favored 'General case' 0 C--N 1.341 0.203 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 179.088 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 9.7 tpt180 -142.08 143.08 32.9 Favored 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 -179.89 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 63.8 t80 -68.03 137.11 54.8 Favored 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 -179.903 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 10.5 m -141.49 153.76 19.81 Favored 'Isoleucine or valine' 0 C--O 1.236 0.375 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 178.592 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -66.11 159.43 26.18 Favored 'General case' 0 N--CA 1.45 -0.438 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 179.273 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -52.18 -41.82 62.96 Favored 'General case' 0 CA--C 1.529 0.135 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 179.641 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 51.2 mt-10 -52.19 -47.37 65.59 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 123.039 0.536 . . . . 0.0 111.075 -179.165 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -61.05 -46.96 88.57 Favored 'General case' 0 C--N 1.341 0.208 0 N-CA-C 110.104 -0.332 . . . . 0.0 110.104 -178.704 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 27.6 ttm105 -58.43 -53.68 55.62 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.338 -178.875 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 29.2 m120 -60.68 -46.1 91.62 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 116.676 -0.238 . . . . 0.0 110.54 -179.275 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -56.63 -47.92 78.66 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 122.428 0.291 . . . . 0.0 110.782 -178.555 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 24.5 t -58.92 -56.64 15.55 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.196 0 N-CA-C 110.319 -0.252 . . . . 0.0 110.319 -179.108 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 20.6 m95 -59.91 -36.39 76.89 Favored 'General case' 0 C--N 1.341 0.201 0 O-C-N 122.568 -0.083 . . . . 0.0 110.888 -178.537 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -65.42 -51.65 58.8 Favored 'General case' 0 N--CA 1.456 -0.172 0 N-CA-C 110.051 -0.352 . . . . 0.0 110.051 179.894 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -57.51 -43.13 83.97 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 122.615 0.366 . . . . 0.0 110.776 -179.026 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 33.0 mt -56.85 -42.67 78.53 Favored 'Isoleucine or valine' 0 C--N 1.34 0.196 0 C-N-CA 122.205 0.202 . . . . 0.0 110.496 -179.447 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 37.0 mtmm -76.82 -36.49 56.87 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 110.024 -0.361 . . . . 0.0 110.024 -179.168 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -60.89 -60.95 2.98 Favored 'General case' 0 N--CA 1.451 -0.402 0 O-C-N 123.259 0.35 . . . . 0.0 110.924 -178.27 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -81.09 -18.69 45.68 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-O 119.624 -0.227 . . . . 0.0 111.268 -177.5 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 5.1 m-70 76.18 128.48 0.04 OUTLIER 'General case' 0 C--N 1.344 0.346 0 C-N-CA 123.411 0.685 . . . . 0.0 109.701 -178.567 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 6.7 t80 . . . . . 0 C--O 1.218 -0.592 0 N-CA-C 108.404 -0.961 . . . . 0.0 108.404 178.168 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.47 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 11.4 tt . . . . . 0 N--CA 1.472 0.668 0 N-CA-C 108.26 -1.015 . . . . 0.0 108.26 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 67.0 mttm -61.11 -62.71 1.65 Allowed 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 123.428 0.691 . . . . 0.0 110.956 -178.114 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -51.94 -48.45 64.27 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.315 -178.98 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 10.9 t -65.01 -38.63 83.29 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.363 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.73 -177.705 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.25 -38.76 90.5 Favored 'General case' 0 CA--C 1.531 0.213 0 N-CA-C 110.414 -0.217 . . . . 0.0 110.414 -179.627 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 64.8 mmtt -73.47 -35.52 65.72 Favored 'General case' 0 CA--C 1.53 0.19 0 N-CA-C 110.121 -0.326 . . . . 0.0 110.121 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.59 -40.41 80.48 Favored 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 178.145 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -70.54 -48.55 54.9 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 123.024 0.53 . . . . 0.0 111.096 -178.585 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 4.6 t-20 -156.28 -137.16 0.06 Allowed 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 110.494 -0.187 . . . . 0.0 110.494 -178.017 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 87.4 t -92.5 -43.01 13.68 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.141 0 C-N-CA 122.873 0.469 . . . . 0.0 110.38 -177.668 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 27.0 t -152.46 167.44 28.75 Favored 'General case' 0 N--CA 1.453 -0.325 0 N-CA-C 110.068 -0.345 . . . . 0.0 110.068 -178.83 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 14.8 t -60.84 -27.75 68.31 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.201 -179.877 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 6.3 m -53.3 -54.14 40.71 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 122.555 0.342 . . . . 0.0 110.223 179.936 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 7.2 m -61.21 -45.45 94.51 Favored 'General case' 0 C--N 1.34 0.177 0 N-CA-C 110.25 -0.278 . . . . 0.0 110.25 -179.321 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 93.4 t -59.4 -38.1 73.18 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.231 0 N-CA-C 109.884 -0.413 . . . . 0.0 109.884 -179.7 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 21.0 t -65.87 -48.31 72.0 Favored 'General case' 0 N--CA 1.449 -0.495 0 N-CA-C 109.314 -0.625 . . . . 0.0 109.314 -179.611 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 59.4 m-70 -52.84 -47.27 67.84 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 110.572 -0.158 . . . . 0.0 110.572 -179.439 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 47.2 t -53.18 -49.95 48.82 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 N-CA-C 109.797 -0.446 . . . . 0.0 109.797 179.767 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 58.1 mt -64.63 -39.07 84.36 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 N-CA-C 110.1 -0.333 . . . . 0.0 110.1 -179.62 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 13.2 m120 -77.51 -4.99 48.44 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 122.22 0.208 . . . . 0.0 110.869 -179.476 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 93.4 mttt 57.33 49.95 12.32 Favored 'General case' 0 C--N 1.344 0.365 0 C-N-CA 122.917 0.487 . . . . 0.0 110.071 -179.701 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 1.1 p -109.63 -79.98 0.58 Allowed 'General case' 0 C--N 1.343 0.285 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 179.752 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 51.2 ttm-85 -72.1 96.6 1.79 Allowed 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 109.168 -0.678 . . . . 0.0 109.168 179.843 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 32.7 t80 -74.91 98.32 3.53 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 109.866 -0.42 . . . . 0.0 109.866 -179.157 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -85.15 177.55 0.59 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.373 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 178.712 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.5 159.38 29.78 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 178.326 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -57.25 -35.37 69.64 Favored 'General case' 0 N--CA 1.455 -0.214 0 N-CA-C 109.935 -0.394 . . . . 0.0 109.935 179.676 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 51.6 mt-10 -58.89 -51.57 69.46 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 122.355 0.262 . . . . 0.0 110.324 179.876 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.56 -43.02 81.66 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 110.067 -0.346 . . . . 0.0 110.067 -178.748 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 29.7 ttm105 -56.42 -51.25 69.07 Favored 'General case' 0 N--CA 1.454 -0.271 0 N-CA-C 110.055 -0.35 . . . . 0.0 110.055 179.902 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 88.7 m-20 -63.11 -45.3 92.66 Favored 'General case' 0 N--CA 1.456 -0.161 0 N-CA-C 110.09 -0.337 . . . . 0.0 110.09 -179.88 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -56.88 -41.87 78.81 Favored 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 110.509 -0.182 . . . . 0.0 110.509 -179.612 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 36.8 t -64.07 -54.58 29.71 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 N-CA-C 109.947 -0.39 . . . . 0.0 109.947 -179.676 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 29.6 m95 -56.91 -39.89 75.26 Favored 'General case' 0 C--N 1.34 0.19 0 N-CA-C 110.466 -0.198 . . . . 0.0 110.466 -179.316 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -65.03 -56.71 11.52 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 179.622 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -50.09 -45.15 52.41 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 123.062 0.545 . . . . 0.0 111.33 -179.001 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 26.0 mt -53.29 -44.2 53.01 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.233 0 C-N-CA 122.297 0.239 . . . . 0.0 110.703 -178.882 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 39.1 ttpt -81.05 -37.35 29.19 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 122.068 0.147 . . . . 0.0 110.61 -177.557 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 70.0 mt-10 -52.19 -58.33 6.93 Favored 'General case' 0 C--N 1.342 0.259 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 -179.083 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -75.92 -46.67 28.77 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 -179.665 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 69.43 130.98 0.03 OUTLIER 'General case' 0 C--N 1.347 0.48 0 C-N-CA 123.22 0.608 . . . . 0.0 109.718 -178.988 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.47 ' CE2' ' HA ' ' A' ' 4' ' ' ILE . 5.1 p90 . . . . . 0 CA--C 1.537 0.446 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 179.398 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.473 0.704 0 N-CA-C 110.253 -0.277 . . . . 0.0 110.253 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -70.78 -59.36 2.85 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 123.075 0.55 . . . . 0.0 110.39 -178.552 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -45.37 -58.56 3.23 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.721 0.808 . . . . 0.0 111.314 -178.422 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 88.3 t -61.44 -47.1 94.99 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.151 0 C-N-CA 122.57 0.348 . . . . 0.0 110.794 -177.15 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -56.74 -44.47 81.73 Favored 'General case' 0 N--CA 1.455 -0.205 0 O-C-N 122.24 -0.288 . . . . 0.0 110.299 -179.548 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.429 ' C ' ' H ' ' A' ' 12' ' ' ASN . 53.0 mttp -72.4 -15.61 61.84 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-O 119.187 -0.435 . . . . 0.0 111.441 -177.887 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 8.6 tpm_? -59.3 -43.87 92.57 Favored 'General case' 0 C--N 1.343 0.297 0 N-CA-C 108.034 -1.098 . . . . 0.0 108.034 177.091 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -99.15 7.08 46.15 Favored 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 176.298 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . 0.429 ' H ' ' C ' ' A' ' 9' ' ' LYS . 47.5 t30 70.74 -84.9 0.03 OUTLIER 'General case' 0 C--N 1.347 0.497 0 C-N-CA 124.519 1.127 . . . . 0.0 110.163 -179.442 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 2.7 t 29.44 -125.2 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.74 0 C-N-CA 124.518 1.127 . . . . 0.0 110.564 -177.845 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.413 ' C ' ' H ' ' A' ' 16' ' ' THR . 1.5 m -175.25 84.52 0.03 OUTLIER 'General case' 0 C--N 1.347 0.487 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 179.084 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.4 p 50.7 -2.5 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 125.252 1.421 . . . . 0.0 114.697 177.591 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.413 ' H ' ' C ' ' A' ' 14' ' ' SER . 0.8 OUTLIER -88.68 -42.47 11.96 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 118.54 0.609 . . . . 0.0 110.669 -177.947 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 13.2 t -51.41 -42.25 61.33 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 122.334 0.253 . . . . 0.0 111.361 -177.908 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 42.4 t -60.12 -54.82 29.5 Favored 'Isoleucine or valine' 0 C--O 1.232 0.134 0 N-CA-C 109.93 -0.396 . . . . 0.0 109.93 -179.076 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 19.7 m -60.0 -42.02 93.38 Favored 'General case' 0 C--O 1.222 -0.361 0 CA-C-N 116.67 -0.241 . . . . 0.0 110.613 -179.496 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 24.3 m170 -62.58 -43.92 97.61 Favored 'General case' 0 CA--C 1.528 0.123 0 C-N-CA 122.202 0.201 . . . . 0.0 110.579 -178.455 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 9.3 t -64.56 -49.61 79.74 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.187 0 C-N-CA 122.249 0.22 . . . . 0.0 110.613 -178.616 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 89.1 mt -65.9 -51.5 60.38 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.23 0 N-CA-C 110.044 -0.354 . . . . 0.0 110.044 -178.669 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 20.4 t-20 -63.88 -31.47 72.67 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 122.649 0.38 . . . . 0.0 111.016 -178.693 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 17.7 ttmt 67.13 40.34 2.88 Favored 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 -177.822 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 12.5 t -74.68 -29.48 61.24 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.331 -179.015 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 2.0 tmt_? -157.96 125.02 5.01 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 -179.423 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 46.4 p90 -59.08 147.87 33.24 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 110.026 -0.361 . . . . 0.0 110.026 -179.878 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -106.66 -173.05 0.42 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.327 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 -179.877 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -79.18 40.93 0.43 Allowed 'General case' 0 CA--C 1.536 0.44 0 O-C-N 122.353 -0.217 . . . . 0.0 111.493 -178.06 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 63.95 -74.58 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 123.347 0.659 . . . . 0.0 111.607 178.238 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -58.88 -35.06 72.38 Favored 'General case' 0 C--N 1.341 0.207 0 C-N-CA 122.5 0.32 . . . . 0.0 110.776 -177.946 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 8.9 m -61.06 -40.65 94.47 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 179.205 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 19.5 ttt180 -71.03 -43.03 68.7 Favored 'General case' 0 N--CA 1.454 -0.235 0 N-CA-C 109.689 -0.486 . . . . 0.0 109.689 179.383 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 35.0 t30 -58.07 -45.02 87.81 Favored 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 109.857 -0.423 . . . . 0.0 109.857 179.217 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -58.26 -42.58 86.77 Favored 'General case' 0 N--CA 1.456 -0.174 0 C-N-CA 122.541 0.337 . . . . 0.0 110.667 -179.505 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 25.6 t -62.67 -53.52 45.95 Favored 'Isoleucine or valine' 0 C--O 1.233 0.225 0 N-CA-C 109.924 -0.398 . . . . 0.0 109.924 -179.737 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 38.8 m95 -59.11 -39.97 83.94 Favored 'General case' 0 C--N 1.339 0.144 0 N-CA-C 110.487 -0.19 . . . . 0.0 110.487 -179.828 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -63.76 -52.32 60.94 Favored 'General case' 0 C--O 1.222 -0.369 0 N-CA-C 110.175 -0.306 . . . . 0.0 110.175 -179.459 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -56.07 -39.77 72.57 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 122.386 0.274 . . . . 0.0 111.334 -178.378 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 19.8 mt -53.34 -56.56 7.75 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 C-N-CA 122.219 0.208 . . . . 0.0 111.399 -177.617 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.3 -26.56 24.86 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 117.688 0.222 . . . . 0.0 111.473 -176.536 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -71.23 -47.71 55.65 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 117.875 0.307 . . . . 0.0 110.544 -178.195 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 79.1 mt -80.08 -14.59 58.4 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-O 119.389 -0.339 . . . . 0.0 110.939 -178.38 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 88.0 m-70 53.35 45.5 28.29 Favored 'General case' 0 C--N 1.348 0.514 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 -178.989 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.547 0.827 0 CA-C-N 115.76 -0.655 . . . . 0.0 112.673 -177.295 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 19.6 tt . . . . . 0 C--O 1.221 -0.444 0 N-CA-C 109.937 -0.394 . . . . 0.0 109.937 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -60.24 -64.15 1.05 Allowed 'General case' 0 N--CA 1.441 -0.91 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.295 -177.887 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -61.27 -52.82 63.15 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 122.963 0.505 . . . . 0.0 111.368 -178.177 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 86.2 t -59.36 -42.59 87.91 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.291 0 CA-C-O 119.517 -0.278 . . . . 0.0 111.272 -176.583 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -54.93 -53.71 52.05 Favored 'General case' 0 C--N 1.341 0.23 0 CA-C-N 118.014 0.37 . . . . 0.0 110.151 -179.128 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 20.1 mmmt -60.68 -47.92 84.12 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 110.006 -0.368 . . . . 0.0 110.006 -178.509 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.49 -37.16 77.52 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 116.455 -0.338 . . . . 0.0 110.624 -178.903 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -73.58 -47.84 37.45 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 122.089 0.156 . . . . 0.0 110.649 -178.489 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 50.1 t30 -171.25 139.78 1.38 Allowed 'General case' 0 C--N 1.347 0.485 0 N-CA-C 110.204 -0.295 . . . . 0.0 110.204 -177.562 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER 23.32 -87.3 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.954 0 C-N-CA 125.162 1.385 . . . . 0.0 112.811 177.636 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 71.8 m -151.18 -172.07 4.11 Favored 'General case' 0 C--N 1.348 0.518 0 C-N-CA 122.647 0.379 . . . . 0.0 110.074 -179.32 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 21.3 p -55.31 -16.19 3.19 Favored 'General case' 0 C--N 1.345 0.401 0 C-N-CA 123.253 0.621 . . . . 0.0 111.518 -179.053 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 4.7 m -52.41 -39.97 61.58 Favored 'General case' 0 CA--C 1.534 0.362 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 177.118 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 75.4 m -69.68 -40.17 76.54 Favored 'General case' 0 C--N 1.342 0.261 0 N-CA-C 109.95 -0.389 . . . . 0.0 109.95 179.054 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 84.0 t -59.46 -37.85 72.03 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.21 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 179.858 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 15.7 m -56.06 -39.12 71.55 Favored 'General case' 0 C--N 1.341 0.196 0 N-CA-C 110.067 -0.346 . . . . 0.0 110.067 179.146 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 23.8 m170 -62.57 -29.71 70.79 Favored 'General case' 0 C--O 1.223 -0.307 0 N-CA-C 110.155 -0.313 . . . . 0.0 110.155 179.991 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.594 HG22 ' HD2' ' A' ' 33' ' ' ARG . 5.1 t -80.42 -49.37 18.82 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.141 0 C-N-CA 122.202 0.201 . . . . 0.0 110.912 -177.97 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 78.9 mt -44.81 -53.99 1.35 Allowed 'Isoleucine or valine' 0 C--N 1.341 0.238 0 C-N-CA 122.811 0.444 . . . . 0.0 111.455 -175.675 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.7 p-10 -114.43 26.74 10.0 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-O 119.861 -0.114 . . . . 0.0 110.923 -177.852 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 74.1 tttt 40.61 51.68 3.01 Favored 'General case' 0 C--N 1.346 0.437 0 C-N-CA 123.009 0.524 . . . . 0.0 110.68 179.62 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -67.12 -31.81 72.52 Favored 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 -179.811 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 59.2 ttt85 -158.1 111.86 2.49 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 179.658 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 48.8 p90 -78.53 136.71 37.63 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 109.205 -0.665 . . . . 0.0 109.205 179.425 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 57.3 t -112.44 83.74 0.69 Allowed 'Isoleucine or valine' 0 N--CA 1.457 -0.121 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 179.703 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 59.44 13.4 3.21 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 115.683 -0.689 . . . . 0.0 111.535 -179.335 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 71.17 -55.93 0.64 Allowed 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 123.912 0.885 . . . . 0.0 111.538 179.431 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -45.14 -46.92 12.22 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.355 0.662 . . . . 0.0 111.853 -177.805 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 32.1 m -58.86 -39.88 82.66 Favored 'General case' 0 N--CA 1.455 -0.207 0 O-C-N 122.226 -0.296 . . . . 0.0 110.266 -178.512 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.594 ' HD2' HG22 ' A' ' 21' ' ' VAL . 20.2 mmt180 -70.42 -40.47 73.8 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 -178.977 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 13.4 m-80 -61.9 -39.73 93.02 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 178.208 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -61.21 -52.17 65.9 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 109.959 -0.386 . . . . 0.0 109.959 179.468 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 53.4 t -55.17 -50.69 62.01 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 N-CA-C 110.116 -0.327 . . . . 0.0 110.116 178.844 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 10.5 m95 -58.59 -40.71 83.99 Favored 'General case' 0 C--N 1.341 0.224 0 N-CA-C 110.368 -0.234 . . . . 0.0 110.368 -179.73 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -62.61 -49.77 73.89 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 179.473 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -56.07 -41.87 75.79 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 122.42 0.288 . . . . 0.0 110.421 179.936 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.406 ' HA ' ' CE1' ' A' ' 45' ' ' TYR . 37.3 mt -61.71 -34.47 62.37 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 N-CA-C 110.461 -0.2 . . . . 0.0 110.461 -179.805 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 4.1 ttpm? -83.0 -36.58 24.91 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 122.362 0.265 . . . . 0.0 110.708 -177.3 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -77.54 -47.79 18.63 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 122.191 0.196 . . . . 0.0 111.502 -177.076 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 79.0 mt -76.98 -29.6 55.6 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-O 119.74 -0.172 . . . . 0.0 110.842 -177.897 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 6.3 m-70 73.78 121.98 0.04 OUTLIER 'General case' 0 C--N 1.344 0.362 0 C-N-CA 123.27 0.628 . . . . 0.0 109.632 -178.612 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.406 ' CE1' ' HA ' ' A' ' 40' ' ' ILE . 3.4 m-85 . . . . . 0 N--CA 1.463 0.185 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 -179.724 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 7.1 mt . . . . . 0 C--O 1.219 -0.54 0 CA-C-O 119.677 -0.202 . . . . 0.0 110.819 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 20.8 ttpp -49.67 -55.75 12.65 Favored 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 111.879 0.325 . . . . 0.0 111.879 -176.754 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 -79.86 -42.28 24.58 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 118.247 0.476 . . . . 0.0 110.553 -176.652 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 28.6 t -57.33 -35.03 47.62 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.36 0 C-N-CA 122.442 0.297 . . . . 0.0 110.586 -180.0 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -52.93 -66.09 0.44 Allowed 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 123.224 0.609 . . . . 0.0 111.042 -178.59 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.95 -35.79 72.33 Favored 'General case' 0 C--N 1.334 -0.107 0 CA-C-O 119.592 -0.242 . . . . 0.0 110.435 -178.971 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 12.5 tpt180 -55.26 -40.35 70.86 Favored 'General case' 0 C--N 1.341 0.206 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 178.743 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -68.78 -62.75 1.25 Allowed 'General case' 0 N--CA 1.448 -0.558 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 177.615 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -177.58 -88.24 0.0 OUTLIER 'General case' 0 C--N 1.351 0.667 0 N-CA-C 112.066 0.395 . . . . 0.0 112.066 178.585 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 55.7 t -69.23 -86.38 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.343 0.291 0 C-N-CA 122.476 0.31 . . . . 0.0 111.205 -174.473 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 9.0 t -158.48 -157.94 0.67 Allowed 'General case' 0 N--CA 1.45 -0.437 0 N-CA-C 110.173 -0.306 . . . . 0.0 110.173 -177.421 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 38.0 p -55.82 -30.17 60.95 Favored 'General case' 0 C--N 1.341 0.221 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.188 -179.532 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 16.6 p -49.94 -44.51 50.5 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 122.756 0.422 . . . . 0.0 110.219 179.127 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 21.3 m -53.24 -36.26 60.88 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 122.43 0.292 . . . . 0.0 110.477 -179.686 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 25.8 t -80.86 -44.26 21.18 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.294 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 179.627 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 14.8 m -55.21 -32.23 62.08 Favored 'General case' 0 C--N 1.344 0.357 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 -179.427 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 62.4 m170 -54.83 -64.72 0.74 Allowed 'General case' 0 N--CA 1.445 -0.696 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.157 179.356 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 15.7 t -62.36 -27.82 43.43 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.246 0 C-N-CA 120.997 -0.281 . . . . 0.0 111.396 -176.495 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 6.1 mm -65.69 -51.68 59.47 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.518 0 CA-C-N 117.872 0.306 . . . . 0.0 110.826 -178.818 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -167.6 31.53 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 117.937 0.335 . . . . 0.0 111.556 -177.595 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 26.6 tptt -158.74 40.11 0.23 Allowed 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 120.69 -0.404 . . . . 0.0 110.624 -179.59 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 10.0 t -79.68 -31.02 41.3 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.664 -176.228 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 56.8 mtm180 57.36 -158.94 0.26 Allowed 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 109.549 -0.537 . . . . 0.0 109.549 179.962 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -80.4 99.17 7.83 Favored 'General case' 0 N--CA 1.453 -0.278 0 O-C-N 122.151 -0.343 . . . . 0.0 110.717 -178.006 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.0 m -143.69 161.55 16.26 Favored 'Isoleucine or valine' 0 C--O 1.233 0.221 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 175.955 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -74.0 170.17 15.98 Favored 'General case' 0 N--CA 1.446 -0.625 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 179.559 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 47.6 mm-40 -64.65 -18.01 64.56 Favored 'General case' 0 C--O 1.223 -0.306 0 N-CA-C 110.178 -0.304 . . . . 0.0 110.178 178.64 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -48.74 -55.14 12.3 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 122.943 0.497 . . . . 0.0 110.92 179.922 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 4.6 p -65.36 -41.22 94.07 Favored 'General case' 0 CA--C 1.531 0.243 0 O-C-N 122.378 -0.201 . . . . 0.0 111.045 -178.153 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 74.6 mtt85 -63.76 -53.66 47.56 Favored 'General case' 0 C--O 1.232 0.175 0 N-CA-C 111.375 0.139 . . . . 0.0 111.375 -177.205 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -69.36 -36.33 76.75 Favored 'General case' 0 C--O 1.223 -0.305 0 CA-C-O 119.677 -0.201 . . . . 0.0 110.732 -176.602 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -58.48 -50.69 72.83 Favored 'General case' 0 C--N 1.342 0.244 0 CA-C-N 117.843 0.292 . . . . 0.0 110.68 -178.99 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 48.7 t -58.06 -58.36 6.71 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.277 0 N-CA-C 110.559 -0.163 . . . . 0.0 110.559 -178.639 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 15.0 m95 -59.3 -40.26 85.65 Favored 'General case' 0 C--N 1.341 0.213 0 N-CA-C 110.747 -0.094 . . . . 0.0 110.747 -178.244 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -59.88 -50.8 72.35 Favored 'General case' 0 C--O 1.22 -0.455 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 -179.458 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -60.25 -47.74 84.71 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 122.026 0.131 . . . . 0.0 110.694 -179.199 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 58.5 mt -55.76 -47.41 79.41 Favored 'Isoleucine or valine' 0 C--N 1.341 0.2 0 C-N-CA 122.324 0.25 . . . . 0.0 111.105 -178.386 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -77.33 -41.14 41.67 Favored 'General case' 0 N--CA 1.448 -0.545 0 N-CA-C 110.372 -0.233 . . . . 0.0 110.372 -176.235 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -57.09 -48.46 78.56 Favored 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 110.161 -0.311 . . . . 0.0 110.161 -178.489 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 55.4 mt -83.7 -20.7 33.01 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.022 -178.458 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 91.4 m-70 55.89 26.53 9.85 Favored 'General case' 0 C--N 1.351 0.632 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 -176.956 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 16.6 t80 . . . . . 0 CA--C 1.535 0.374 0 C-N-CA 123.319 0.648 . . . . 0.0 109.772 -175.541 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.467 0.404 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 26.2 mmtp -46.53 -62.07 1.53 Allowed 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 122.837 0.455 . . . . 0.0 111.187 179.043 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 30.1 m-20 -91.17 -32.46 15.8 Favored 'General case' 0 C--N 1.347 0.468 0 CA-C-N 117.909 0.322 . . . . 0.0 111.425 -176.337 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 70.4 t -58.12 -42.97 84.46 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 179.222 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.94 -42.64 97.27 Favored 'General case' 0 C--O 1.22 -0.451 0 N-CA-C 110.372 -0.233 . . . . 0.0 110.372 179.823 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 41.3 mtpt -61.34 -47.51 85.57 Favored 'General case' 0 C--N 1.338 0.108 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 179.627 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -55.19 -39.89 70.09 Favored 'General case' 0 N--CA 1.454 -0.233 0 N-CA-C 109.492 -0.559 . . . . 0.0 109.492 179.602 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -70.31 -56.55 6.45 Favored 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 110.368 -0.234 . . . . 0.0 110.368 179.847 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 45.2 t30 -170.91 126.34 0.7 Allowed 'General case' 0 C--N 1.347 0.487 0 CA-C-N 117.387 0.085 . . . . 0.0 111.194 -177.743 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 51.3 t 51.68 -91.31 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.539 0 C-N-CA 123.895 0.878 . . . . 0.0 111.809 176.419 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 28.3 m -157.44 -169.93 3.06 Favored 'General case' 0 C--N 1.346 0.417 0 N-CA-C 109.785 -0.45 . . . . 0.0 109.785 -177.591 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 80.4 p -49.87 -26.7 4.3 Favored 'General case' 0 C--N 1.347 0.496 0 C-N-CA 123.212 0.605 . . . . 0.0 111.104 -179.771 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 18.6 p -50.25 -44.19 53.42 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 122.396 0.279 . . . . 0.0 110.289 179.063 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.3 t -59.88 -37.63 79.89 Favored 'General case' 0 CA--C 1.534 0.333 0 N-CA-C 110.563 -0.162 . . . . 0.0 110.563 -178.621 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 64.6 t -68.62 -45.6 81.29 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.246 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 179.821 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 20.2 m -57.16 -45.74 83.35 Favored 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 179.076 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 52.2 m170 -57.66 -46.32 84.38 Favored 'General case' 0 C--N 1.339 0.152 0 C-N-CA 122.353 0.261 . . . . 0.0 110.373 -179.743 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 32.9 t -65.41 -51.93 58.04 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.05 -178.101 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 94.9 mt -59.49 -54.1 39.14 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.217 0 N-CA-C 110.377 -0.231 . . . . 0.0 110.377 -177.912 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 43.5 m-80 -70.61 -18.98 62.88 Favored 'General case' 0 CA--C 1.532 0.288 0 N-CA-C 110.386 -0.227 . . . . 0.0 110.386 -179.007 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 74.2 tttt 61.05 46.14 8.56 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 122.878 0.471 . . . . 0.0 109.928 179.476 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 15.8 p -96.25 -80.18 0.43 Allowed 'General case' 0 C--N 1.341 0.199 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 179.632 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 78.7 ttt180 -78.81 100.76 7.29 Favored 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 108.968 -0.752 . . . . 0.0 108.968 179.15 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 90.8 t80 -62.11 144.13 55.73 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 109.967 -0.383 . . . . 0.0 109.967 -179.995 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 5.4 m -130.67 170.8 18.83 Favored 'Isoleucine or valine' 0 CA--C 1.523 -0.081 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 179.463 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -61.78 158.4 15.85 Favored 'General case' 0 N--CA 1.45 -0.449 0 N-CA-C 109.978 -0.379 . . . . 0.0 109.978 179.796 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 50.7 mm-40 -48.73 -45.01 38.9 Favored 'General case' 0 C--N 1.34 0.178 0 CA-C-N 116.042 -0.526 . . . . 0.0 109.889 179.049 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -52.85 -53.7 45.07 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 122.715 0.406 . . . . 0.0 111.436 -178.146 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 10.0 m -61.15 -51.94 66.96 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 117.804 0.274 . . . . 0.0 110.817 -177.179 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 30.9 ttp180 -58.53 -52.76 64.27 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 122.02 0.128 . . . . 0.0 110.798 -177.931 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 90.5 m-20 -63.34 -40.67 97.94 Favored 'General case' 0 N--CA 1.455 -0.189 0 N-CA-C 110.465 -0.198 . . . . 0.0 110.465 -178.025 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -61.14 -47.85 84.31 Favored 'General case' 0 C--O 1.224 -0.258 0 N-CA-C 110.284 -0.265 . . . . 0.0 110.284 -179.885 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 13.1 t -54.31 -52.41 39.08 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 179.926 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 26.0 m95 -62.85 -38.21 89.9 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 110.059 -0.348 . . . . 0.0 110.059 179.874 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -89.01 28.12 1.24 Allowed 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 122.251 0.22 . . . . 0.0 110.606 179.784 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -131.14 -46.63 1.01 Allowed 'General case' 0 N--CA 1.456 -0.14 0 N-CA-C 108.474 -0.936 . . . . 0.0 108.474 176.76 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 60.7 mt -55.48 -46.77 78.9 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.224 0 N-CA-C 109.839 -0.43 . . . . 0.0 109.839 178.902 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 4.6 ptpp? -107.81 32.93 4.36 Favored 'General case' 0 C--N 1.344 0.365 0 C-N-CA 122.144 0.178 . . . . 0.0 110.634 -178.609 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -138.77 -55.75 0.61 Allowed 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 179.181 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -85.18 13.67 6.06 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 110.048 -0.352 . . . . 0.0 110.048 179.309 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 3.8 t-80 78.39 149.95 0.11 Allowed 'General case' 0 N--CA 1.446 -0.632 0 CA-C-O 121.807 0.813 . . . . 0.0 110.88 177.644 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 26.2 t80 . . . . . 0 C--N 1.32 -0.692 0 CA-C-N 114.336 -1.302 . . . . 0.0 108.812 179.003 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 52.6 ttp . . . . . 0 N--CA 1.473 0.709 0 N-CA-C 109.754 -0.462 . . . . 0.0 109.754 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -157.01 163.88 38.6 Favored 'General case' 0 C--O 1.234 0.267 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 24.7 m -158.0 -64.74 0.09 Allowed 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 121.899 0.079 . . . . 0.0 110.911 -178.083 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.487 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 0.3 OUTLIER -152.03 -40.76 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.567 0 N-CA-C 109.94 -0.392 . . . . 0.0 109.94 -177.468 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 34.5 ttmt -55.55 -39.65 70.89 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 122.846 0.458 . . . . 0.0 111.081 -178.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -51.51 -64.93 0.65 Allowed 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 122.898 0.479 . . . . 0.0 111.414 -176.731 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 86.8 t -69.39 -31.81 50.87 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.371 0 N-CA-C 110.646 -0.131 . . . . 0.0 110.646 -177.211 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.04 -41.97 97.58 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 110.267 -0.272 . . . . 0.0 110.267 -179.888 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 31.4 mmtm -81.3 -31.58 33.53 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 122.439 0.296 . . . . 0.0 110.822 -179.168 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 1.3 tpm_? -75.64 -47.52 26.07 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 117.427 0.103 . . . . 0.0 111.047 -177.898 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -80.68 -49.03 11.74 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 122.163 0.185 . . . . 0.0 111.006 -177.073 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 22.4 m-80 -123.66 -145.41 0.34 Allowed 'General case' 0 C--N 1.341 0.23 0 N-CA-C 109.735 -0.469 . . . . 0.0 109.735 -177.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 58.6 t -102.22 -41.95 8.42 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.249 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 -179.902 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 8.3 t -155.16 176.85 12.02 Favored 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 109.925 -0.398 . . . . 0.0 109.925 -179.752 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 12.6 m -61.47 -21.47 64.2 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.617 -179.284 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 3.7 m -52.18 -49.16 64.38 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 110.179 -0.304 . . . . 0.0 110.179 179.379 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 7.1 m -65.43 -33.32 75.66 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 122.148 0.179 . . . . 0.0 110.722 -179.369 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 58.5 t -68.32 -45.58 82.31 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 -179.79 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 60.4 p -60.42 -35.72 76.47 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-O 119.731 -0.176 . . . . 0.0 110.739 -178.787 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 55.0 m170 -52.61 -37.54 58.45 Favored 'General case' 0 C--N 1.347 0.466 0 CA-C-O 120.568 0.223 . . . . 0.0 110.631 -179.882 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 60.1 t -72.35 -40.2 64.37 Favored 'Isoleucine or valine' 0 C--O 1.234 0.278 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.493 -178.88 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 76.2 mt -68.84 -56.18 13.04 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.194 0 C-N-CA 122.405 0.282 . . . . 0.0 110.514 -177.854 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 31.1 p30 -76.55 -10.92 59.74 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 119.701 -0.19 . . . . 0.0 111.216 -177.877 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 39.7 mtmt 56.45 38.7 29.91 Favored 'General case' 0 C--N 1.345 0.411 0 C-N-CA 122.674 0.389 . . . . 0.0 110.319 179.257 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 10.3 t -82.23 -34.18 28.97 Favored 'General case' 0 C--N 1.34 0.155 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 179.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 89.2 mtt-85 -134.18 69.97 1.46 Allowed 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 178.236 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 87.5 t80 -59.47 111.16 1.29 Allowed 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 116.097 -0.501 . . . . 0.0 109.78 -179.038 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.577 HG12 ' H ' ' A' ' 29' ' ' ALA . 12.0 t -76.13 173.68 0.93 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 179.31 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.577 ' H ' HG12 ' A' ' 28' ' ' VAL . . . -76.89 52.61 0.87 Allowed 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 122.337 0.255 . . . . 0.0 111.455 -178.056 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 69.08 -32.16 0.22 Allowed 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.025 0.93 . . . . 0.0 112.975 177.023 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 51.6 mt-10 -50.87 -61.93 1.91 Allowed 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 118.52 0.6 . . . . 0.0 110.836 -177.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 45.5 m -61.14 -41.19 96.29 Favored 'General case' 0 C--O 1.225 -0.204 0 CA-C-N 116.738 -0.21 . . . . 0.0 110.599 -178.482 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 12.1 ttm180 -56.04 -55.39 33.4 Favored 'General case' 0 CA--C 1.531 0.247 0 N-CA-C 110.286 -0.265 . . . . 0.0 110.286 -179.152 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 21.5 m120 -61.84 -46.05 91.14 Favored 'General case' 0 N--CA 1.455 -0.201 0 N-CA-C 110.282 -0.266 . . . . 0.0 110.282 -179.353 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -56.84 -43.07 80.74 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 122.194 0.198 . . . . 0.0 110.785 -179.12 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 16.4 t -63.43 -57.47 11.72 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.184 0 N-CA-C 110.339 -0.245 . . . . 0.0 110.339 -178.875 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 19.0 m95 -58.87 -37.79 77.35 Favored 'General case' 0 CA--C 1.53 0.197 0 N-CA-C 110.682 -0.118 . . . . 0.0 110.682 -178.466 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -66.02 -53.13 42.52 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 109.953 -0.388 . . . . 0.0 109.953 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.96 -41.62 87.93 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 122.54 0.336 . . . . 0.0 110.893 -178.611 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 19.7 mt -53.37 -46.14 57.67 Favored 'Isoleucine or valine' 0 C--N 1.34 0.194 0 C-N-CA 122.218 0.207 . . . . 0.0 110.547 -179.38 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 7.8 mtpm? -79.82 -37.35 35.28 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 110.303 -0.258 . . . . 0.0 110.303 -177.848 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -59.34 -57.28 13.68 Favored 'General case' 0 N--CA 1.451 -0.379 0 N-CA-C 110.109 -0.33 . . . . 0.0 110.109 -178.523 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -70.91 -43.21 68.76 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 -179.68 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 9.9 t60 65.03 118.72 0.02 OUTLIER 'General case' 0 C--N 1.349 0.567 0 C-N-CA 123.462 0.705 . . . . 0.0 110.091 -178.834 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.487 ' CE2' ' HA ' ' A' ' 4' ' ' ILE . 0.0 OUTLIER -156.46 50.32 0.5 Allowed 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.276 -179.4 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 10.4 t -50.99 119.25 11.61 Favored Pre-proline 0 CA--C 1.537 0.457 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.058 -179.171 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 4.5 Cg_endo -64.0 -26.3 66.27 Favored 'Trans proline' 0 N--CA 1.451 -1.019 0 C-N-CA 122.48 2.12 . . . . 0.0 110.885 -179.801 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 50.6 m -148.96 138.83 22.03 Favored 'General case' 0 N--CA 1.455 -0.202 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 179.395 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . 64.78 91.0 0.08 Allowed 'General case' 0 C--N 1.343 0.284 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 -178.63 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 8.0 p -65.65 -30.61 50.64 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.377 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.711 -179.149 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -60.33 -66.33 0.54 Allowed 'General case' 0 C--N 1.342 0.269 0 N-CA-C 110.369 -0.234 . . . . 0.0 110.369 -179.162 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 31.2 ttt180 -163.26 -143.8 0.08 Allowed 'General case' 0 N--CA 1.449 -0.497 0 N-CA-C 108.544 -0.91 . . . . 0.0 108.544 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 30.8 p -169.11 112.6 0.53 Allowed 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 -179.588 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -159.39 159.42 33.75 Favored 'General case' 0 N--CA 1.455 -0.187 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 179.795 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 12.3 tptp 57.2 -148.52 0.49 Allowed 'General case' 0 CA--C 1.538 0.519 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 19.2 m . . . . . 0 C--O 1.25 1.11 0 CA-C-O 117.01 -1.471 . . . . 0.0 108.92 179.905 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 20.8 ptm . . . . . 0 N--CA 1.475 0.801 0 N-CA-C 110.053 -0.351 . . . . 0.0 110.053 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 71.47 146.2 0.07 Allowed 'General case' 0 C--N 1.344 0.354 0 C-N-CA 123.315 0.646 . . . . 0.0 110.41 -179.809 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . 0.551 ' O ' HG22 ' A' ' 7' ' ' VAL . 68.4 m -163.1 -51.78 0.04 OUTLIER 'General case' 0 C--N 1.342 0.257 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 -178.865 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 15.3 tt -47.64 -33.47 3.29 Favored 'Isoleucine or valine' 0 C--N 1.349 0.581 0 C-N-CA 123.326 0.651 . . . . 0.0 111.214 -179.468 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 3.6 mmmm -70.19 -58.96 3.19 Favored 'General case' 0 N--CA 1.447 -0.576 0 N-CA-C 110.175 -0.305 . . . . 0.0 110.175 -179.735 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -59.83 -56.75 17.89 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 123.403 0.44 . . . . 0.0 111.749 -176.948 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.551 HG22 ' O ' ' A' ' 3' ' ' THR . 17.1 m -43.55 -56.07 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 C-N-CA 122.83 0.452 . . . . 0.0 112.196 -174.039 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.508 ' H ' HG23 ' A' ' 7' ' ' VAL . . . -48.17 -50.24 29.7 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.769 -178.329 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 8.5 mptt -74.66 -34.32 62.69 Favored 'General case' 0 CA--C 1.534 0.347 0 O-C-N 122.436 -0.165 . . . . 0.0 110.736 -178.496 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 11.0 mmt-85 -58.78 -56.19 25.4 Favored 'General case' 0 C--N 1.341 0.205 0 N-CA-C 109.502 -0.555 . . . . 0.0 109.502 179.093 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -68.96 -8.23 42.64 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.688 179.498 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 60.9 63.11 1.33 Allowed 'General case' 0 C--N 1.343 0.291 0 C-N-CA 123.018 0.527 . . . . 0.0 110.254 178.963 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 2.1 m -137.2 -109.48 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.455 -0.191 0 N-CA-C 108.518 -0.919 . . . . 0.0 108.518 177.677 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 10.0 p -169.25 147.05 3.67 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 179.812 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 9.3 t -51.39 -33.06 28.38 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.534 179.552 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 20.2 p -49.83 -54.21 20.76 Favored 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 109.863 -0.421 . . . . 0.0 109.863 179.075 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 10.5 m -53.31 -46.05 69.23 Favored 'General case' 0 N--CA 1.456 -0.151 0 C-N-CA 122.63 0.372 . . . . 0.0 110.094 179.466 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 20.1 t -64.85 -27.08 41.62 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.18 0 CA-C-N 116.433 -0.348 . . . . 0.0 110.824 -178.577 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 45.2 m -77.42 -48.86 16.12 Favored 'General case' 0 CA--C 1.506 -0.732 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 179.844 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 18.2 m-70 -55.54 -39.82 71.08 Favored 'General case' 0 C--O 1.201 -1.47 0 O-C-N 123.329 0.393 . . . . 0.0 110.046 -179.626 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 19.6 t -52.16 -32.89 16.12 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.389 0 CA-C-N 118.192 0.451 . . . . 0.0 110.784 -179.367 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 32.1 mm -75.33 -34.96 31.89 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.415 0 N-CA-C 111.989 0.366 . . . . 0.0 111.989 -177.738 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.3 p-10 -100.56 -40.32 7.47 Favored 'General case' 0 N--CA 1.481 1.097 0 CA-C-N 118.398 0.545 . . . . 0.0 111.337 -176.486 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.821 ' O ' HG23 ' A' ' 25' ' ' THR . 36.2 ttpt -153.74 -89.89 0.05 OUTLIER 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 108.13 -1.063 . . . . 0.0 108.13 179.142 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . 0.821 HG23 ' O ' ' A' ' 24' ' ' LYS . 0.8 OUTLIER 173.53 -41.75 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.294 0.637 . . . . 0.0 110.283 177.605 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 38.3 ttt85 57.91 46.12 17.22 Favored 'General case' 0 CA--C 1.535 0.385 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 -178.099 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 22.5 t80 74.19 126.18 0.04 OUTLIER 'General case' 0 C--N 1.346 0.456 0 C-N-CA 123.615 0.766 . . . . 0.0 110.684 -179.804 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 5.8 m -141.96 168.06 15.17 Favored 'Isoleucine or valine' 0 C--N 1.342 0.254 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 178.766 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -100.59 25.78 7.43 Favored 'General case' 0 CA--C 1.531 0.218 0 N-CA-C 109.897 -0.409 . . . . 0.0 109.897 179.38 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 68.5 -65.81 0.26 Allowed 'General case' 0 C--N 1.352 0.684 0 C-N-CA 123.909 0.883 . . . . 0.0 110.704 -179.398 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 68.1 mt-10 -53.54 -33.71 55.59 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 122.775 0.43 . . . . 0.0 110.803 -179.824 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 9.9 p -66.8 -54.81 18.76 Favored 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 -179.374 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 2.4 tmt_? -55.53 -45.64 77.14 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 110.079 -0.341 . . . . 0.0 110.079 179.821 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 86.6 m-20 -64.43 -48.74 74.2 Favored 'General case' 0 CA--C 1.53 0.199 0 N-CA-C 110.493 -0.188 . . . . 0.0 110.493 -179.073 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -58.04 -43.63 86.91 Favored 'General case' 0 C--N 1.34 0.157 0 N-CA-C 110.336 -0.246 . . . . 0.0 110.336 -179.455 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 21.7 t -56.81 -54.21 32.44 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.214 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 179.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 18.0 m95 -60.66 -39.88 90.01 Favored 'General case' 0 N--CA 1.456 -0.154 0 N-CA-C 110.568 -0.16 . . . . 0.0 110.568 -179.532 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -58.83 -52.37 66.01 Favored 'General case' 0 N--CA 1.455 -0.193 0 N-CA-C 109.946 -0.39 . . . . 0.0 109.946 -179.067 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -62.62 -44.52 96.08 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 122.294 0.238 . . . . 0.0 110.508 -179.774 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 29.4 mt -58.12 -39.11 71.45 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.196 0 N-CA-C 110.247 -0.279 . . . . 0.0 110.247 -179.658 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 65.2 mmtt -78.1 -34.11 50.27 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 109.925 -0.398 . . . . 0.0 109.925 -178.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -63.85 -58.48 6.66 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 110.407 -0.22 . . . . 0.0 110.407 -178.946 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 79.2 mt -85.62 -2.13 57.85 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 122.223 0.209 . . . . 0.0 110.913 -178.547 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 4.4 m-70 63.71 13.37 7.34 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 123.137 0.575 . . . . 0.0 110.767 -179.42 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 7.6 t80 32.42 57.95 0.39 Allowed 'General case' 0 C--N 1.347 0.472 0 C-N-CA 124.035 0.934 . . . . 0.0 111.153 -178.7 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 13.4 m -77.63 121.01 83.66 Favored Pre-proline 0 CA--C 1.535 0.375 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -69.29 -59.6 0.09 OUTLIER 'Trans proline' 0 N--CA 1.446 -1.28 0 C-N-CA 122.328 2.019 . . . . 0.0 110.027 179.578 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 13.9 m -89.65 -174.02 4.16 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.007 -179.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -148.77 -47.54 0.15 Allowed 'General case' 0 C--N 1.341 0.235 0 N-CA-C 109.739 -0.467 . . . . 0.0 109.739 179.682 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.419 ' H ' HG22 ' A' ' 50' ' ' VAL . 5.2 m -73.93 70.8 0.25 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 CA-C-O 121.016 0.436 . . . . 0.0 110.041 179.966 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -161.91 -42.8 0.04 OUTLIER 'General case' 0 N--CA 1.456 -0.17 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 -179.883 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 14.2 ttt85 -146.94 -145.1 0.16 Allowed 'General case' 0 N--CA 1.449 -0.508 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 179.629 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 36.3 t -172.26 -62.22 0.02 OUTLIER 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 108.577 -0.898 . . . . 0.0 108.577 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 10.4 mp -86.27 168.79 13.59 Favored 'General case' 0 N--CA 1.455 -0.225 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 178.634 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 7.2 mtmp? -71.13 -173.63 0.87 Allowed 'General case' 0 C--O 1.235 0.311 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 179.635 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 16.8 m . . . . . 0 C--O 1.257 1.46 0 CA-C-O 116.838 -1.553 . . . . 0.0 109.097 178.21 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 91.6 mtp . . . . . 0 N--CA 1.473 0.699 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 54.87 61.17 3.08 Favored 'General case' 0 C--N 1.344 0.348 0 O-C-N 123.348 0.405 . . . . 0.0 110.191 -179.807 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 17.4 p -123.89 -59.93 1.48 Allowed 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 179.834 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.418 ' O ' HD13 ' A' ' 4' ' ' ILE . 0.1 OUTLIER -56.4 -45.07 81.58 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.437 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 179.913 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 27.1 mmtp -59.52 -58.79 7.04 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 120.733 0.301 . . . . 0.0 110.381 -178.552 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -57.36 -50.64 72.32 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.624 -179.121 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.485 HG22 HD12 ' A' ' 43' ' ' LEU . 29.3 t -53.66 -54.51 18.74 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.092 0 C-N-CA 123.045 0.538 . . . . 0.0 110.491 -179.715 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -55.09 -58.61 6.95 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.728 -177.332 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 32.6 mtmm -59.63 -34.57 72.95 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 110.422 -0.214 . . . . 0.0 110.422 -177.775 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 49.2 tpt85 -64.91 -35.12 80.13 Favored 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 177.061 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -84.56 8.21 17.42 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 122.691 0.396 . . . . 0.0 110.256 178.236 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 8.1 t-20 69.98 42.42 1.02 Allowed 'General case' 0 C--N 1.346 0.447 0 C-N-CA 123.974 0.909 . . . . 0.0 111.454 177.424 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 3.6 m -145.16 143.35 22.27 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.518 0 N-CA-C 108.21 -1.033 . . . . 0.0 108.21 176.03 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 74.3 m -71.7 -65.65 0.73 Allowed 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.865 -0.42 . . . . 0.0 109.865 -178.257 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 5.2 t 179.71 -33.02 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 123.964 0.905 . . . . 0.0 108.869 -179.753 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 11.7 p -57.84 -49.08 77.89 Favored 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 178.272 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 12.0 m -56.76 -36.09 69.4 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 110.228 -0.286 . . . . 0.0 110.228 179.215 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 71.6 t -69.99 -38.47 75.42 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.178 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 178.218 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 17.4 m -61.66 -33.36 73.84 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 109.755 -0.461 . . . . 0.0 109.755 179.152 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 50.8 m170 -61.29 -30.48 70.51 Favored 'General case' 0 C--N 1.346 0.431 0 N-CA-C 110.385 -0.228 . . . . 0.0 110.385 179.496 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 93.1 t -63.96 -52.04 61.67 Favored 'Isoleucine or valine' 0 C--N 1.341 0.215 0 N-CA-C 109.522 -0.547 . . . . 0.0 109.522 179.911 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 4.8 mm -64.41 -49.96 78.42 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.164 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 179.656 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 33.8 t-20 -59.86 -31.75 70.06 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 116.528 -0.305 . . . . 0.0 110.205 -179.262 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 31.9 ttpt 64.34 46.02 3.61 Favored 'General case' 0 CA--C 1.532 0.282 0 N-CA-C 109.503 -0.555 . . . . 0.0 109.503 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 15.2 p -115.55 -87.06 0.6 Allowed 'General case' 0 C--N 1.341 0.233 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 -179.847 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 47.5 mmm-85 -94.73 54.6 1.78 Allowed 'General case' 0 C--O 1.233 0.22 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 -179.34 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 27.6 p90 -72.57 144.24 47.98 Favored 'General case' 0 N--CA 1.453 -0.287 0 N-CA-C 109.379 -0.601 . . . . 0.0 109.379 179.7 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 19.7 t -87.54 80.1 1.77 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.286 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 -179.548 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 54.55 -143.33 0.74 Allowed 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.203 179.397 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 69.1 mt-10 -115.05 -25.27 8.2 Favored 'General case' 0 CA--C 1.528 0.125 0 C-N-CA 122.892 0.477 . . . . 0.0 110.284 179.705 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 70.0 mm-40 -55.24 -61.8 2.09 Favored 'General case' 0 C--O 1.232 0.163 0 N-CA-C 110.148 -0.315 . . . . 0.0 110.148 -179.783 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 9.6 m -62.65 -40.1 95.96 Favored 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 179.925 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 13.9 ttm180 -52.03 -48.96 64.3 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 122.701 0.4 . . . . 0.0 110.308 -179.657 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 22.4 t-20 -71.09 -47.52 57.76 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.336 -179.174 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -54.63 -39.79 68.31 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 122.42 0.288 . . . . 0.0 110.945 -178.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 17.5 t -60.39 -60.88 1.91 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.279 0 N-CA-C 109.84 -0.43 . . . . 0.0 109.84 -179.524 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 26.0 m95 -58.34 -37.33 74.94 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-O 119.969 -0.062 . . . . 0.0 110.946 -178.196 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -61.37 -55.93 26.07 Favored 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 109.808 -0.442 . . . . 0.0 109.808 179.069 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.5 -42.49 87.78 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 122.611 0.364 . . . . 0.0 110.895 -179.033 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 27.4 mt -52.71 -56.87 5.51 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.193 0 C-N-CA 122.54 0.336 . . . . 0.0 110.703 -178.779 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -83.67 0.09 48.47 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-O 119.6 -0.238 . . . . 0.0 111.541 -176.818 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.6 tm-20 -88.7 -46.48 8.98 Favored 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 109.181 -0.674 . . . . 0.0 109.181 179.435 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.485 HD12 HG22 ' A' ' 7' ' ' VAL . 6.9 mt -72.38 -92.32 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 119.27 -0.395 . . . . 0.0 110.71 -178.514 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 54.9 m80 -158.79 18.0 0.2 Allowed 'General case' 0 C--N 1.352 0.694 0 N-CA-C 112.763 0.653 . . . . 0.0 112.763 -175.608 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 66.7 t80 -67.46 109.98 3.43 Favored 'General case' 0 N--CA 1.464 0.234 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 179.003 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 31.4 t -158.64 85.72 2.41 Favored Pre-proline 0 N--CA 1.453 -0.312 0 N-CA-C 109.826 -0.435 . . . . 0.0 109.826 -179.348 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 10.8 Cg_endo -72.11 76.06 2.2 Favored 'Trans proline' 0 N--CA 1.447 -1.253 0 C-N-CA 122.651 2.234 . . . . 0.0 109.501 178.569 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 12.3 t -93.12 158.22 15.88 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.31 -178.772 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . 63.04 20.96 12.62 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.304 0.642 . . . . 0.0 111.255 179.366 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 26.8 m -144.63 147.03 19.65 Favored 'Isoleucine or valine' 0 C--N 1.341 0.235 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 178.75 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -165.46 -112.19 0.01 OUTLIER 'General case' 0 N--CA 1.455 -0.175 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 179.63 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 17.5 ptm180 -67.19 -24.34 65.85 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 177.738 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 29.5 m -140.18 175.33 9.68 Favored 'General case' 0 C--N 1.344 0.327 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 179.132 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -80.05 176.76 9.46 Favored 'General case' 0 N--CA 1.454 -0.23 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 179.3 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 60.3 pttt -62.68 -25.13 68.0 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 110.396 -0.224 . . . . 0.0 110.396 179.462 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 7.5 p . . . . . 0 C--O 1.253 1.258 0 CA-C-O 116.567 -1.683 . . . . 0.0 108.927 179.574 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 45.1 ttm . . . . . 0 N--CA 1.476 0.861 0 N-CA-C 109.931 -0.396 . . . . 0.0 109.931 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -65.49 80.58 0.06 Allowed 'General case' 0 C--N 1.343 0.292 0 C-N-CA 122.661 0.385 . . . . 0.0 110.899 -178.476 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -156.82 29.33 0.32 Allowed 'General case' 0 N--CA 1.468 0.438 0 N-CA-C 110.111 -0.329 . . . . 0.0 110.111 -179.64 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.1 mt 57.8 24.86 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.625 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 -177.198 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -82.29 -58.06 3.1 Favored 'General case' 0 N--CA 1.45 -0.454 0 C-N-CA 123.412 0.685 . . . . 0.0 110.41 -177.588 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 32.9 m-20 -82.23 -34.24 28.95 Favored 'General case' 0 C--O 1.224 -0.268 0 N-CA-C 110.377 -0.231 . . . . 0.0 110.377 -177.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 31.2 t -54.16 -52.56 36.48 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.259 0 N-CA-C 110.092 -0.336 . . . . 0.0 110.092 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.65 -45.73 88.84 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-O 120.499 0.19 . . . . 0.0 110.663 -178.853 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 18.3 mmtp -67.1 -24.71 65.96 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-O 119.614 -0.231 . . . . 0.0 111.224 -178.132 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 1.6 tmm_? -60.65 -43.61 97.38 Favored 'General case' 0 C--N 1.343 0.316 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 177.887 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -85.18 -0.28 54.08 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 178.466 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 67.39 48.73 1.11 Allowed 'General case' 0 C--N 1.345 0.411 0 C-N-CA 123.202 0.601 . . . . 0.0 110.268 178.651 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 27.6 m -143.22 174.1 5.28 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 178.531 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 21.3 m -88.69 161.84 16.62 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 122.672 0.389 . . . . 0.0 110.074 -179.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 14.1 t -56.4 -32.35 64.73 Favored 'General case' 0 N--CA 1.463 0.223 0 C-N-CA 122.509 0.324 . . . . 0.0 110.763 -179.851 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 13.8 p -58.86 -45.62 89.69 Favored 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 178.823 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -55.94 -42.35 76.03 Favored 'General case' 0 N--CA 1.453 -0.278 0 N-CA-C 109.884 -0.413 . . . . 0.0 109.884 179.612 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 78.5 t -64.87 -43.47 96.33 Favored 'Isoleucine or valine' 0 C--N 1.34 0.177 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 179.185 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 14.4 t -57.67 -37.25 73.09 Favored 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 110.151 -0.314 . . . . 0.0 110.151 179.622 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 54.7 m170 -59.13 -28.07 66.21 Favored 'General case' 0 C--N 1.344 0.332 0 N-CA-C 110.398 -0.223 . . . . 0.0 110.398 -179.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 36.7 t -77.79 -43.69 29.0 Favored 'Isoleucine or valine' 0 C--O 1.232 0.154 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 178.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 77.2 mt -57.98 -58.42 6.44 Favored 'Isoleucine or valine' 0 C--N 1.34 0.163 0 N-CA-C 109.519 -0.548 . . . . 0.0 109.519 -179.436 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 26.5 p30 -73.84 -14.42 61.08 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 110.283 -0.266 . . . . 0.0 110.283 -179.849 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 62.22 32.63 17.15 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 122.978 0.511 . . . . 0.0 111.254 177.035 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 14.8 t -70.23 -29.32 66.12 Favored 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 177.56 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 74.3 mtt85 -141.81 98.33 3.32 Favored 'General case' 0 C--N 1.343 0.309 0 N-CA-C 108.115 -1.069 . . . . 0.0 108.115 178.148 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 88.5 t80 -65.88 108.6 2.21 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 110.234 -0.284 . . . . 0.0 110.234 -178.601 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 30.3 m -72.82 172.88 0.96 Allowed 'Isoleucine or valine' 0 N--CA 1.457 -0.118 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 178.235 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -65.03 159.3 23.44 Favored 'General case' 0 N--CA 1.449 -0.477 0 N-CA-C 109.684 -0.487 . . . . 0.0 109.684 178.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 29.5 mm-40 -50.63 -43.01 56.86 Favored 'General case' 0 C--O 1.223 -0.336 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.155 179.473 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 9.5 tm-20 -52.17 -53.23 45.68 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 122.217 0.207 . . . . 0.0 110.632 -179.364 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 10.0 m -65.55 -52.66 50.75 Favored 'General case' 0 N--CA 1.442 -0.855 0 CA-C-O 119.593 -0.242 . . . . 0.0 111.453 -175.25 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 6.8 ppt_? -62.19 -39.51 92.97 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 118.277 0.49 . . . . 0.0 110.958 -176.784 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 49.2 m-80 -67.17 -46.61 73.47 Favored 'General case' 0 C--N 1.34 0.194 0 N-CA-C 109.549 -0.537 . . . . 0.0 109.549 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -58.64 -42.01 87.36 Favored 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 110.21 -0.293 . . . . 0.0 110.21 179.717 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 18.8 t -63.94 -58.3 7.92 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.216 0 C-N-CA 122.381 0.272 . . . . 0.0 110.314 -179.514 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 19.3 m95 -57.87 -37.76 74.51 Favored 'General case' 0 C--N 1.342 0.261 0 N-CA-C 110.444 -0.206 . . . . 0.0 110.444 -178.371 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -64.13 -52.55 58.59 Favored 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 179.266 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -55.74 -45.46 78.0 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 122.449 0.3 . . . . 0.0 111.038 -178.602 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 46.5 mt -55.26 -43.53 71.33 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 C-N-CA 122.2 0.2 . . . . 0.0 110.985 -178.116 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 36.6 mtmm -78.32 -43.54 27.61 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 109.983 -0.377 . . . . 0.0 109.983 -177.541 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 24.0 mm-40 -57.15 -47.77 80.36 Favored 'General case' 0 N--CA 1.448 -0.542 0 O-C-N 123.152 0.282 . . . . 0.0 110.761 -178.466 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -85.52 -0.68 55.69 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-O 119.669 -0.205 . . . . 0.0 110.636 -178.876 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 21.2 m80 57.14 38.47 29.01 Favored 'General case' 0 C--N 1.345 0.406 0 C-N-CA 122.651 0.38 . . . . 0.0 110.689 178.687 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 1.5 m-85 -58.64 108.23 0.61 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.258 179.791 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 23.1 t -130.99 79.95 70.41 Favored Pre-proline 0 N--CA 1.449 -0.479 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 178.025 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 3.6 Cg_exo -59.79 154.62 48.42 Favored 'Trans proline' 0 N--CA 1.449 -1.104 0 C-N-CA 122.536 2.157 . . . . 0.0 110.332 -179.223 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . 0.401 ' O ' ' HB3' ' A' ' 49' ' ' ALA . 4.7 t 73.78 105.12 0.07 Allowed 'General case' 0 C--N 1.344 0.359 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 -178.395 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.401 ' HB3' ' O ' ' A' ' 48' ' ' SER . . . 69.84 -175.44 0.19 Allowed 'General case' 0 C--N 1.341 0.231 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 -178.204 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 4.1 t 51.77 55.36 0.36 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 -179.014 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -77.77 73.67 4.33 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 116.174 -0.466 . . . . 0.0 109.901 -179.103 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 51.9 ttt180 76.65 -55.48 0.57 Allowed 'General case' 0 C--N 1.343 0.307 0 C-N-CA 123.477 0.711 . . . . 0.0 110.22 179.415 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 16.5 m 56.71 63.71 1.87 Allowed 'General case' 0 C--N 1.342 0.24 0 C-N-CA 122.722 0.409 . . . . 0.0 110.305 179.166 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 43.8 mt -59.75 146.91 39.81 Favored 'General case' 0 C--O 1.232 0.141 0 N-CA-C 109.827 -0.435 . . . . 0.0 109.827 179.887 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -159.76 41.73 0.2 Allowed 'General case' 0 CA--C 1.531 0.214 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 -179.784 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 57.2 t . . . . . 0 C--O 1.253 1.258 0 CA-C-O 116.658 -1.639 . . . . 0.0 108.831 -179.853 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 51.7 tpp . . . . . 0 N--CA 1.472 0.655 0 N-CA-C 109.63 -0.507 . . . . 0.0 109.63 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -137.38 81.01 1.84 Allowed 'General case' 0 C--N 1.341 0.202 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 -179.607 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 47.3 p -127.19 175.2 8.32 Favored 'General case' 0 CA--C 1.531 0.216 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 179.636 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 21.3 tt -55.12 -32.47 27.76 Favored 'Isoleucine or valine' 0 C--N 1.344 0.369 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 179.144 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -60.47 -60.25 4.11 Favored 'General case' 0 N--CA 1.447 -0.608 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 178.993 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 29.2 m-20 -54.22 -43.36 70.75 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.262 179.379 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 42.8 t -59.53 -36.67 66.12 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.28 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 178.409 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -68.11 -40.04 82.63 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 110.273 -0.269 . . . . 0.0 110.273 179.755 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 52.9 mttt -62.48 -40.44 96.69 Favored 'General case' 0 C--N 1.343 0.289 0 N-CA-C 108.485 -0.931 . . . . 0.0 108.485 177.733 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 27.1 mtt180 -60.03 -43.58 95.2 Favored 'General case' 0 C--N 1.341 0.229 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 176.415 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -73.77 9.85 1.33 Allowed 'General case' 0 CA--C 1.541 0.635 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.632 177.023 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 8.1 m-80 75.07 149.19 0.1 Allowed 'General case' 0 C--N 1.353 0.739 0 C-N-CA 124.296 1.038 . . . . 0.0 111.613 177.199 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 40.8 t 64.02 -86.6 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.455 -0.18 0 CA-C-N 114.393 -1.276 . . . . 0.0 110.559 177.116 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 9.3 t -174.88 -162.74 0.12 Allowed 'General case' 0 C--O 1.233 0.234 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 -177.045 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 20.0 p -57.91 -19.93 33.49 Favored 'General case' 0 C--O 1.222 -0.347 0 C-N-CA 123.133 0.573 . . . . 0.0 111.314 -179.282 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 4.6 m -53.5 -49.51 67.38 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 110.277 -0.268 . . . . 0.0 110.277 179.668 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 26.1 m -62.4 -44.3 96.78 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 110.296 -0.261 . . . . 0.0 110.296 -179.289 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 92.6 t -61.29 -42.25 92.84 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 -179.839 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 50.3 m -61.3 -40.72 95.21 Favored 'General case' 0 N--CA 1.454 -0.243 0 N-CA-C 110.159 -0.311 . . . . 0.0 110.159 -179.496 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 47.0 m170 -59.36 -41.3 88.93 Favored 'General case' 0 C--N 1.339 0.149 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 -179.825 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 54.0 t -70.47 -52.48 28.93 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 O-C-N 123.035 0.21 . . . . 0.0 110.791 -178.674 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 93.1 mt -63.44 -51.87 65.22 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 N-CA-C 110.393 -0.225 . . . . 0.0 110.393 -177.635 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 14.6 t-20 -68.56 -34.88 76.6 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-O 119.665 -0.207 . . . . 0.0 110.517 -178.483 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 23.1 mtmm 70.56 60.09 0.22 Allowed 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 123.373 0.669 . . . . 0.0 109.507 -179.398 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 19.3 p -87.33 -80.35 0.26 Allowed 'General case' 0 C--N 1.34 0.167 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 179.201 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 8.7 ptm180 -86.76 163.1 17.48 Favored 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 109.843 -0.429 . . . . 0.0 109.843 179.41 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 89.1 t80 -80.99 142.25 33.62 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 179.617 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 9.0 m -141.17 158.19 22.61 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.183 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 178.544 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -73.22 160.2 32.28 Favored 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 179.499 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 15.1 mm-40 -58.53 -24.38 60.47 Favored 'General case' 0 C--O 1.223 -0.298 0 N-CA-C 110.099 -0.334 . . . . 0.0 110.099 179.071 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.7 tm-20 -56.21 -53.01 62.28 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 109.705 -0.48 . . . . 0.0 109.705 178.034 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 3.9 m -64.03 -48.68 75.35 Favored 'General case' 0 N--CA 1.449 -0.517 0 C-N-CA 122.247 0.219 . . . . 0.0 110.477 -177.487 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 28.3 mtm180 -57.84 -54.25 48.99 Favored 'General case' 0 CA--C 1.528 0.119 0 N-CA-C 110.051 -0.351 . . . . 0.0 110.051 -179.16 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 48.6 t30 -57.73 -48.82 78.51 Favored 'General case' 0 C--O 1.224 -0.272 0 C-N-CA 122.785 0.434 . . . . 0.0 110.339 -178.828 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -55.85 -47.16 77.77 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 122.112 0.165 . . . . 0.0 110.651 -178.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 39.2 t -63.44 -56.4 17.29 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.15 0 N-CA-C 110.474 -0.195 . . . . 0.0 110.474 -178.82 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 19.5 m95 -57.21 -40.19 76.99 Favored 'General case' 0 C--O 1.233 0.202 0 N-CA-C 110.516 -0.179 . . . . 0.0 110.516 -178.56 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -64.09 -49.59 71.65 Favored 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 -179.781 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -70.44 0.15 7.21 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-O 119.499 -0.286 . . . . 0.0 111.536 -178.68 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 21.8 mt -102.91 -46.72 10.83 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.195 0 N-CA-C 109.899 -0.408 . . . . 0.0 109.899 178.895 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 1.1 ttpm? -93.19 -30.35 15.26 Favored 'General case' 0 C--N 1.343 0.318 0 N-CA-C 112.25 0.463 . . . . 0.0 112.25 -176.078 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 49.5 mm-40 -86.46 -30.56 21.93 Favored 'General case' 0 C--N 1.34 0.172 0 CA-C-N 118.371 0.532 . . . . 0.0 110.558 -177.72 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -73.76 -29.1 62.02 Favored 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 110.356 -0.239 . . . . 0.0 110.356 -179.323 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 19.1 m80 59.57 57.73 3.16 Favored 'General case' 0 C--N 1.346 0.426 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 -179.481 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 9.2 p90 -71.6 17.25 0.09 Allowed 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.896 -178.631 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 34.0 t 55.14 69.94 1.81 Allowed Pre-proline 0 CA--C 1.536 0.404 0 C-N-CA 122.913 0.485 . . . . 0.0 110.416 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_exo -57.45 127.64 26.28 Favored 'Trans proline' 0 N--CA 1.448 -1.186 0 C-N-CA 122.525 2.15 . . . . 0.0 110.214 179.053 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 17.3 m -79.9 53.77 1.73 Allowed 'General case' 0 CA--C 1.53 0.202 0 N-CA-C 110.387 -0.227 . . . . 0.0 110.387 -179.186 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -69.18 -44.73 71.6 Favored 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 179.345 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 53.3 t -70.4 -30.47 43.13 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.204 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 179.313 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 56.27 51.78 11.15 Favored 'General case' 0 C--N 1.345 0.412 0 C-N-CA 122.869 0.468 . . . . 0.0 110.087 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 10.6 tpt85 -155.83 -138.6 0.07 Allowed 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 179.708 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 58.1 p -158.49 128.25 5.83 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 -179.714 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 5.5 tt -62.45 -41.46 98.76 Favored 'General case' 0 CA--C 1.531 0.223 0 N-CA-C 110.221 -0.288 . . . . 0.0 110.221 -179.536 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 22.1 mmmt 56.21 73.83 0.42 Allowed 'General case' 0 C--N 1.347 0.46 0 C-N-CA 122.919 0.488 . . . . 0.0 110.327 179.775 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 8.8 p . . . . . 0 C--O 1.254 1.313 0 CA-C-O 117.117 -1.421 . . . . 0.0 109.704 179.113 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.7 mpt? . . . . . 0 N--CA 1.472 0.663 0 N-CA-C 110.037 -0.357 . . . . 0.0 110.037 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -84.74 69.61 10.7 Favored 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 179.53 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 22.9 p -138.36 163.43 31.87 Favored 'General case' 0 CA--C 1.519 -0.212 0 CA-C-O 121.077 0.465 . . . . 0.0 110.497 -179.412 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -58.0 -29.62 36.71 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.406 0 CA-C-N 115.336 -0.847 . . . . 0.0 109.774 176.594 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 28.9 mtpp -58.51 -64.92 0.75 Allowed 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 122.492 0.317 . . . . 0.0 110.757 -178.763 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -58.9 -44.85 91.28 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.64 -0.254 . . . . 0.0 110.623 -179.379 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 53.5 t -56.53 -45.2 82.07 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 179.577 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.6 -45.09 91.92 Favored 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 110.397 -0.224 . . . . 0.0 110.397 -179.74 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 34.9 mtmm -58.55 -41.49 85.71 Favored 'General case' 0 C--N 1.341 0.237 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 178.512 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.43 -35.23 76.98 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 108.748 -0.834 . . . . 0.0 108.748 177.911 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -88.58 15.64 7.76 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.471 178.458 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 64.2 t30 85.26 145.91 0.06 Allowed 'General case' 0 C--N 1.353 0.738 0 C-N-CA 124.281 1.032 . . . . 0.0 111.487 177.74 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 4.9 t 65.24 -116.6 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.471 0 CA-C-N 114.907 -1.042 . . . . 0.0 109.814 178.461 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 7.9 t -166.25 -161.69 0.49 Allowed 'General case' 0 C--N 1.344 0.341 0 CA-C-N 118.491 0.587 . . . . 0.0 110.247 -178.758 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 39.1 p -54.26 -23.32 14.41 Favored 'General case' 0 C--N 1.342 0.261 0 C-N-CA 123.189 0.596 . . . . 0.0 111.744 -177.881 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 13.2 t -56.2 -38.53 71.11 Favored 'General case' 0 C--O 1.222 -0.385 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 179.257 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 58.0 m -65.72 -35.32 80.42 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 109.922 -0.399 . . . . 0.0 109.922 179.767 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 62.3 t -69.98 -52.71 28.48 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.336 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 179.868 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 85.3 p -53.42 -40.31 65.02 Favored 'General case' 0 C--N 1.343 0.298 0 N-CA-C 110.524 -0.176 . . . . 0.0 110.524 -178.634 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 57.7 m170 -54.05 -36.41 63.04 Favored 'General case' 0 C--N 1.345 0.386 0 C-N-CA 122.27 0.228 . . . . 0.0 110.396 179.112 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 59.2 t -78.49 -35.02 18.57 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.224 0 CA-C-N 116.687 -0.233 . . . . 0.0 110.397 -179.288 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 25.5 mm -67.23 -50.84 59.4 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.218 0 CA-C-N 117.889 0.313 . . . . 0.0 110.214 -179.285 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 34.6 p30 -87.27 -8.67 56.52 Favored 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 111.674 0.25 . . . . 0.0 111.674 -177.645 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 54.25 36.75 25.84 Favored 'General case' 0 C--N 1.345 0.399 0 C-N-CA 122.616 0.367 . . . . 0.0 110.388 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 7.0 t -82.12 -30.1 31.34 Favored 'General case' 0 CA--C 1.531 0.247 0 N-CA-C 110.307 -0.257 . . . . 0.0 110.307 -179.291 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 60.1 mtp85 -128.31 116.95 20.61 Favored 'General case' 0 C--N 1.344 0.344 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 47.4 t80 -71.72 108.38 5.02 Favored 'General case' 0 N--CA 1.453 -0.285 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 -179.668 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 4.6 m -107.35 38.55 0.37 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.376 0 C-N-CA 122.551 0.341 . . . . 0.0 110.549 -178.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 60.73 -179.91 0.1 Allowed 'General case' 0 C--N 1.343 0.302 0 CA-C-O 121.111 0.482 . . . . 0.0 111.179 178.869 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 58.1 mm-40 -77.77 -25.64 49.23 Favored 'General case' 0 C--O 1.223 -0.298 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.286 179.693 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -58.3 -64.92 0.75 Allowed 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 110.471 -0.196 . . . . 0.0 110.471 -178.666 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 2.2 m -61.26 -44.29 97.48 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 110.091 -0.337 . . . . 0.0 110.091 -178.674 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 44.1 ttm105 -53.54 -55.8 22.49 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 122.826 0.451 . . . . 0.0 110.613 -179.336 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -63.36 -48.03 79.65 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 122.424 0.289 . . . . 0.0 110.496 -178.873 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.65 -47.32 70.46 Favored 'General case' 0 C--N 1.34 0.157 0 C-N-CA 122.187 0.195 . . . . 0.0 110.674 -178.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 37.9 t -62.78 -57.41 12.16 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.223 0 N-CA-C 110.173 -0.306 . . . . 0.0 110.173 -179.484 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 13.1 m95 -56.57 -32.13 64.89 Favored 'General case' 0 C--N 1.343 0.283 0 CA-C-N 117.463 0.119 . . . . 0.0 110.946 -178.235 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -71.59 -67.48 0.52 Allowed 'General case' 0 N--CA 1.447 -0.581 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 179.075 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -48.08 -40.54 23.58 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 122.692 0.397 . . . . 0.0 111.555 -178.11 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 1.5 mm -44.71 -54.4 1.23 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.206 0 C-N-CA 123.095 0.558 . . . . 0.0 111.27 -178.326 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 24.3 pttm -100.84 -31.78 10.99 Favored 'General case' 0 CA--C 1.534 0.33 0 N-CA-C 112.187 0.44 . . . . 0.0 112.187 -176.112 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 76.1 mm-40 -73.5 -40.19 64.25 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 118.04 0.382 . . . . 0.0 110.989 -176.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.0 tt -77.33 -36.43 53.93 Favored 'General case' 0 CA--C 1.527 0.084 0 N-CA-C 110.179 -0.304 . . . . 0.0 110.179 -178.688 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 15.2 m80 76.93 134.28 0.06 Allowed 'General case' 0 C--N 1.346 0.444 0 C-N-CA 123.619 0.768 . . . . 0.0 109.735 -178.975 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 3.7 p90 -146.91 152.27 38.41 Favored 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 178.301 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . 0.412 ' CB ' ' HD3' ' A' ' 47' ' ' PRO . 1.7 m -49.18 -65.66 0.77 Allowed Pre-proline 0 CA--C 1.543 0.691 0 CA-C-O 118.543 -0.741 . . . . 0.0 112.581 -174.735 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . 0.412 ' HD3' ' CB ' ' A' ' 46' ' ' SER . 17.5 Cg_endo -69.63 72.73 1.36 Allowed 'Trans proline' 0 C--N 1.359 1.11 0 C-N-CA 122.225 1.95 . . . . 0.0 111.049 -179.605 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 22.3 t -137.8 146.17 43.22 Favored 'General case' 0 N--CA 1.455 -0.193 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 179.887 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -73.52 -45.09 55.79 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.31 -179.513 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 8.9 t -81.53 63.39 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.294 0 N-CA-C 109.806 -0.442 . . . . 0.0 109.806 -178.653 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -83.88 52.75 2.36 Favored 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 178.853 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 12.3 mmm180 -113.69 -38.65 4.23 Favored 'General case' 0 C--N 1.34 0.192 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 -178.956 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 41.4 m -77.08 66.96 2.98 Favored 'General case' 0 N--CA 1.455 -0.187 0 N-CA-C 109.973 -0.38 . . . . 0.0 109.973 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 28.0 mt -70.19 -49.21 52.59 Favored 'General case' 0 N--CA 1.455 -0.187 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 -179.897 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -158.08 160.81 37.77 Favored 'General case' 0 N--CA 1.452 -0.326 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 179.633 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 58.4 t . . . . . 0 C--O 1.249 1.028 0 CA-C-O 116.586 -1.673 . . . . 0.0 109.625 -179.318 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.8 tmt? . . . . . 0 N--CA 1.471 0.598 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -162.2 155.86 21.01 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 179.621 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.1 p -107.95 157.4 18.24 Favored 'General case' 0 N--CA 1.453 -0.275 0 C-N-CA 122.684 0.394 . . . . 0.0 110.145 -178.837 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -59.43 -28.28 39.33 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.286 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.246 -179.691 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 58.2 mtmt -48.43 -63.05 1.19 Allowed 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 122.947 0.499 . . . . 0.0 110.583 179.41 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -58.38 -44.97 89.15 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.722 -178.45 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 97.1 t -57.12 -43.34 81.27 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.184 0 N-CA-C 110.319 -0.252 . . . . 0.0 110.319 -179.168 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.71 -40.08 93.78 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 122.386 0.275 . . . . 0.0 110.715 -178.702 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -64.65 -49.32 71.47 Favored 'General case' 0 C--O 1.227 -0.125 0 N-CA-C 109.521 -0.548 . . . . 0.0 109.521 179.447 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.38 -31.76 73.1 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.258 179.844 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -71.41 -53.22 14.79 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 122.241 0.216 . . . . 0.0 110.635 -178.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 42.7 t30 -147.94 -82.65 0.12 Allowed 'General case' 0 C--N 1.342 0.264 0 CA-C-O 119.682 -0.199 . . . . 0.0 111.06 -177.851 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 95.2 t -140.68 -66.87 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.348 0.514 0 CA-C-N 117.68 0.218 . . . . 0.0 110.911 -176.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 74.4 m -132.43 172.48 12.42 Favored 'General case' 0 C--N 1.344 0.365 0 CA-C-O 120.995 0.426 . . . . 0.0 110.892 -176.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 43.0 p -53.91 -31.72 51.04 Favored 'General case' 0 C--O 1.223 -0.314 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.438 -178.696 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 12.8 t -49.4 -44.8 45.45 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 122.099 0.159 . . . . 0.0 110.936 -178.992 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 6.6 m -57.52 -28.83 63.82 Favored 'General case' 0 C--N 1.342 0.281 0 CA-C-O 119.687 -0.197 . . . . 0.0 111.116 -178.756 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 40.2 t -88.33 -37.08 9.99 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.223 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 179.098 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 25.4 m -57.08 -45.86 82.97 Favored 'General case' 0 CA--C 1.519 -0.233 0 C-N-CA 122.474 0.31 . . . . 0.0 110.473 -177.347 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 52.9 m-70 -56.13 -43.16 77.93 Favored 'General case' 0 C--O 1.209 -1.064 0 N-CA-C 110.177 -0.305 . . . . 0.0 110.177 -179.497 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 3.2 t -58.27 -29.5 37.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 O-C-N 121.9 -0.5 . . . . 0.0 112.325 -176.204 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 2.7 mt -79.85 -29.41 12.89 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.462 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 -176.239 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 6.4 p30 -117.37 -33.7 4.54 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 118.613 0.642 . . . . 0.0 112.168 -175.488 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 174.08 102.9 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 -177.521 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 65.5 p -48.83 -33.34 10.32 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 112.722 0.638 . . . . 0.0 112.722 -177.609 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 74.68 -164.0 0.08 Allowed 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 -177.148 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 5.1 t80 -79.24 96.14 5.84 Favored 'General case' 0 CA--C 1.531 0.232 0 O-C-N 122.249 -0.282 . . . . 0.0 110.779 -178.209 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 1.6 m -149.22 151.21 13.2 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.236 0 N-CA-C 108.576 -0.898 . . . . 0.0 108.576 176.9 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.88 153.66 42.99 Favored 'General case' 0 N--CA 1.447 -0.605 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 178.855 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 38.3 mp0 -55.21 -34.09 63.64 Favored 'General case' 0 CA--C 1.527 0.088 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 179.589 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -53.84 -41.84 67.84 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 122.66 0.384 . . . . 0.0 110.804 -179.857 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 1.7 m -66.22 -22.73 66.35 Favored 'General case' 0 C--N 1.346 0.432 0 N-CA-C 110.234 -0.284 . . . . 0.0 110.234 -178.202 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 3.0 mmp_? -85.07 -47.03 10.59 Favored 'General case' 0 C--N 1.343 0.312 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 179.762 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 28.2 m120 -54.19 -43.66 70.91 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 179.51 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -58.02 -41.61 83.51 Favored 'General case' 0 N--CA 1.453 -0.307 0 O-C-N 123.165 0.291 . . . . 0.0 111.317 -179.523 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 38.4 t -66.16 -57.17 11.5 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.195 0 CA-C-N 117.609 0.186 . . . . 0.0 110.551 -177.919 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 33.9 m95 -65.45 -30.77 71.6 Favored 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 110.719 -0.104 . . . . 0.0 110.719 -177.315 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -67.24 -51.12 57.05 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 177.505 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.23 -41.55 84.36 Favored 'General case' 0 C--N 1.342 0.266 0 C-N-CA 122.362 0.265 . . . . 0.0 110.334 179.74 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 3.2 mm -54.39 -50.82 54.53 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.272 0 C-N-CA 122.788 0.435 . . . . 0.0 110.315 179.782 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 20.4 tptm -74.11 -33.16 63.49 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 110.243 -0.28 . . . . 0.0 110.243 -178.014 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -63.96 -63.35 1.18 Allowed 'General case' 0 N--CA 1.448 -0.539 0 C-N-CA 122.368 0.267 . . . . 0.0 110.947 -177.61 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 82.3 mt -83.49 -20.79 33.32 Favored 'General case' 0 C--N 1.338 0.088 0 CA-C-O 119.47 -0.3 . . . . 0.0 111.503 -176.768 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 73.87 138.47 0.06 Allowed 'General case' 0 C--N 1.345 0.407 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 -178.279 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 8.7 t80 -125.21 142.01 51.75 Favored 'General case' 0 C--N 1.333 -0.126 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 179.487 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 1.7 t -105.77 111.15 64.69 Favored Pre-proline 0 CA--C 1.539 0.535 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 179.049 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 8.6 Cg_endo -68.67 -172.59 0.48 Allowed 'Trans proline' 0 N--CA 1.453 -0.856 0 C-N-CA 122.526 2.151 . . . . 0.0 110.821 -179.753 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 15.4 m -47.53 -42.16 22.75 Favored 'General case' 0 C--N 1.346 0.441 0 N-CA-C 109.941 -0.392 . . . . 0.0 109.941 178.892 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -76.58 84.75 3.26 Favored 'General case' 0 N--CA 1.449 -0.498 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 176.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 86.5 t -48.49 120.35 0.84 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.175 0 C-N-CA 122.748 0.419 . . . . 0.0 110.083 -178.461 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -77.69 70.51 4.07 Favored 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 179.781 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 20.7 tpt180 -58.68 -33.09 69.75 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 122.617 0.367 . . . . 0.0 110.305 -179.633 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 22.8 t -62.67 -31.38 72.26 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 122.295 0.238 . . . . 0.0 110.384 179.869 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 73.4 mt 55.39 -105.07 0.25 Allowed 'General case' 0 C--N 1.347 0.459 0 C-N-CA 122.907 0.483 . . . . 0.0 109.886 -179.309 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 39.5 ttmt -159.65 143.55 14.66 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 61.7 t . . . . . 0 C--O 1.254 1.293 0 CA-C-O 116.541 -1.695 . . . . 0.0 108.838 179.637 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.2 tmt? . . . . . 0 N--CA 1.472 0.642 0 N-CA-C 110.02 -0.363 . . . . 0.0 110.02 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -161.1 59.18 0.3 Allowed 'General case' 0 C--N 1.341 0.235 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 179.598 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 40.2 p -124.27 -178.58 4.14 Favored 'General case' 0 CA--C 1.517 -0.309 0 CA-C-O 121.385 0.612 . . . . 0.0 110.306 -179.792 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 33.9 pt -57.35 -25.02 22.77 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.776 0 CA-C-N 115.033 -0.985 . . . . 0.0 109.673 176.265 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 36.5 mtpt -65.71 -63.11 1.17 Allowed 'General case' 0 N--CA 1.448 -0.536 0 N-CA-C 109.549 -0.537 . . . . 0.0 109.549 179.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -49.41 -49.83 43.19 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.447 178.843 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 64.4 t -58.78 -51.75 68.33 Favored 'Isoleucine or valine' 0 C--N 1.341 0.224 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.299 -179.239 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -55.6 -54.56 42.62 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 122.28 0.232 . . . . 0.0 110.64 -178.726 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 61.9 mtpt -58.83 -38.85 79.61 Favored 'General case' 0 N--CA 1.453 -0.283 0 O-C-N 123.113 0.258 . . . . 0.0 110.457 -178.371 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 14.1 tpt180 -63.41 -36.82 84.98 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 177.701 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -82.75 7.86 13.83 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 122.417 0.287 . . . . 0.0 110.241 177.862 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 76.53 -35.79 0.25 Allowed 'General case' 0 C--N 1.35 0.591 0 C-N-CA 124.144 0.977 . . . . 0.0 111.888 177.823 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.416 HG23 ' H ' ' A' ' 13' ' ' VAL . 0.0 OUTLIER -78.05 -170.99 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 CA-C-N 118.321 0.509 . . . . 0.0 110.384 -178.003 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 11.2 t -102.93 179.78 4.18 Favored 'General case' 0 C--N 1.345 0.372 0 C-N-CA 122.824 0.45 . . . . 0.0 110.439 -178.468 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 19.4 p -58.02 -29.21 65.14 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 123.106 0.562 . . . . 0.0 111.644 -177.372 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 12.5 t -53.91 -38.23 64.62 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 117.814 0.279 . . . . 0.0 110.667 -179.298 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . 0.522 ' O ' HG23 ' A' ' 21' ' ' VAL . 87.2 m -67.4 -36.68 81.78 Favored 'General case' 0 N--CA 1.451 -0.393 0 O-C-N 122.168 -0.332 . . . . 0.0 110.152 -179.361 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 66.7 t -73.96 -41.02 53.0 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 N-CA-C 109.931 -0.396 . . . . 0.0 109.931 -179.62 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 94.0 p -59.88 -41.31 91.28 Favored 'General case' 0 N--CA 1.453 -0.278 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 179.021 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 55.2 m170 -56.5 -35.45 68.03 Favored 'General case' 0 C--N 1.346 0.436 0 N-CA-C 110.085 -0.339 . . . . 0.0 110.085 177.827 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.549 HG22 ' HD2' ' A' ' 33' ' ' ARG . 99.4 t -72.94 -57.79 6.27 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.162 0 C-N-CA 122.376 0.27 . . . . 0.0 110.68 -177.714 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 34.2 mm -57.0 -48.46 81.69 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.157 0 N-CA-C 110.368 -0.234 . . . . 0.0 110.368 -177.509 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 34.9 m-80 -73.8 -28.86 61.85 Favored 'General case' 0 CA--C 1.53 0.192 0 N-CA-C 110.496 -0.187 . . . . 0.0 110.496 -179.27 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 34.3 ttpt 57.01 53.72 7.72 Favored 'General case' 0 C--N 1.344 0.327 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 -179.124 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 13.9 t -108.46 -43.3 4.35 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.849 -177.432 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 27.0 tpt180 -85.54 109.66 18.67 Favored 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 109.408 -0.59 . . . . 0.0 109.408 -179.013 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 66.4 t80 -64.64 144.68 57.05 Favored 'General case' 0 N--CA 1.456 -0.149 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.268 -179.802 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 5.5 m -147.81 -171.05 0.25 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 -179.567 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -85.53 28.89 0.72 Allowed 'General case' 0 CA--C 1.539 0.526 0 CA-C-O 119.621 -0.228 . . . . 0.0 111.322 -179.325 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 72.56 -65.64 0.34 Allowed 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 123.427 0.691 . . . . 0.0 111.564 178.086 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -42.76 -47.13 5.39 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.355 0.662 . . . . 0.0 111.599 -176.872 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 6.6 m -50.48 -39.95 49.62 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 122.426 0.29 . . . . 0.0 111.026 -179.195 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.549 ' HD2' HG22 ' A' ' 21' ' ' VAL . 3.4 mpt_? -82.38 -42.45 18.64 Favored 'General case' 0 N--CA 1.46 0.058 0 N-CA-C 109.992 -0.373 . . . . 0.0 109.992 -178.789 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 20.2 t30 -54.41 -43.45 71.5 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 110.014 -0.365 . . . . 0.0 110.014 179.364 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -56.98 -49.0 77.09 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 122.537 0.335 . . . . 0.0 110.272 179.858 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 84.8 t -62.85 -49.28 84.28 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 N-CA-C 109.824 -0.436 . . . . 0.0 109.824 179.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 18.4 m95 -53.84 -40.27 66.31 Favored 'General case' 0 C--N 1.341 0.236 0 N-CA-C 110.05 -0.352 . . . . 0.0 110.05 179.767 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -66.55 -47.59 72.36 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 178.41 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -53.75 -39.57 65.45 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 122.425 0.29 . . . . 0.0 110.974 -179.482 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 1.1 mp -53.69 -39.75 39.84 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.384 0 N-CA-C 110.231 -0.285 . . . . 0.0 110.231 179.792 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 57.4 tptt -86.71 -40.25 15.23 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 122.244 0.218 . . . . 0.0 110.744 -177.328 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 47.2 mm-40 -61.68 -51.8 66.94 Favored 'General case' 0 N--CA 1.456 -0.175 0 N-CA-C 110.04 -0.355 . . . . 0.0 110.04 -177.696 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 61.3 tp -83.78 -82.54 0.16 Allowed 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 179.571 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 2.5 p-80 161.8 145.31 0.01 OUTLIER 'General case' 0 C--N 1.345 0.372 0 C-N-CA 124.24 1.016 . . . . 0.0 108.589 -179.835 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 29.5 t80 -161.6 147.49 13.85 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 178.887 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 46.9 t -118.16 88.88 33.62 Favored Pre-proline 0 CA--C 1.534 0.363 0 C-N-CA 122.565 0.346 . . . . 0.0 110.233 -178.819 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo -64.3 -53.78 1.02 Allowed 'Trans proline' 0 N--CA 1.447 -1.22 0 C-N-CA 122.433 2.088 . . . . 0.0 110.13 178.619 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 43.3 t -161.99 150.22 14.94 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 109.298 -0.63 . . . . 0.0 109.298 -179.972 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -72.22 -42.69 65.44 Favored 'General case' 0 N--CA 1.451 -0.387 0 N-CA-C 109.619 -0.511 . . . . 0.0 109.619 179.39 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 28.1 t 68.3 149.03 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.349 0.547 0 C-N-CA 123.682 0.793 . . . . 0.0 110.281 -179.909 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -78.13 71.76 4.62 Favored 'General case' 0 N--CA 1.454 -0.225 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 179.6 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 80.2 mtt-85 -78.22 63.94 3.25 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 109.893 -0.41 . . . . 0.0 109.893 -179.428 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 77.4 p -84.82 -176.23 6.12 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 109.546 -0.539 . . . . 0.0 109.546 179.533 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 11.2 tp 56.43 72.54 0.49 Allowed 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 122.719 0.408 . . . . 0.0 109.935 179.612 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 4.8 mptp? -73.53 128.21 34.87 Favored 'General case' 0 N--CA 1.454 -0.262 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 179.694 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 95.2 t . . . . . 0 C--O 1.252 1.22 0 CA-C-O 116.818 -1.563 . . . . 0.0 108.764 179.515 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 72.3 mtm . . . . . 0 N--CA 1.472 0.663 0 N-CA-C 110.027 -0.361 . . . . 0.0 110.027 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -62.52 153.64 31.16 Favored 'General case' 0 C--O 1.235 0.298 0 N-CA-C 110.051 -0.351 . . . . 0.0 110.051 179.917 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 18.4 p -111.03 175.4 5.43 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 20.2 tt -56.69 -31.77 35.89 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.304 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 179.4 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 9.0 mtmp? -59.75 -65.84 0.61 Allowed 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 122.575 0.35 . . . . 0.0 110.125 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -54.96 -51.3 66.61 Favored 'General case' 0 N--CA 1.456 -0.147 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.513 -178.698 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 55.0 t -55.99 -49.86 72.92 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 C-N-CA 122.658 0.383 . . . . 0.0 110.643 -178.196 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.0 -50.47 70.61 Favored 'General case' 0 N--CA 1.456 -0.168 0 C-N-CA 122.175 0.19 . . . . 0.0 111.186 -177.743 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 41.9 tttm -62.08 -36.03 80.46 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 122.071 0.149 . . . . 0.0 110.624 -178.024 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 21.7 tpp180 -72.44 -41.25 66.36 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 109.754 -0.462 . . . . 0.0 109.754 179.588 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -64.89 -57.42 8.85 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 122.541 0.337 . . . . 0.0 111.129 -178.384 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 22.1 m120 -135.74 -121.36 0.16 Allowed 'General case' 0 C--N 1.342 0.253 0 N-CA-C 110.299 -0.26 . . . . 0.0 110.299 -177.22 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 94.5 t -87.69 -58.8 3.17 Favored 'Isoleucine or valine' 0 C--N 1.342 0.266 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 -178.351 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 52.4 p -167.48 -164.04 0.56 Allowed 'General case' 0 C--O 1.232 0.155 0 N-CA-C 109.912 -0.403 . . . . 0.0 109.912 -179.06 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 27.9 m -56.88 -27.39 60.45 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.557 179.914 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 23.5 p -59.79 -54.56 44.81 Favored 'General case' 0 C--N 1.341 0.236 0 N-CA-C 110.068 -0.345 . . . . 0.0 110.068 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -62.57 -20.91 65.17 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-O 119.52 -0.276 . . . . 0.0 111.084 -179.337 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 39.4 t -82.04 -53.27 12.29 Favored 'Isoleucine or valine' 0 C--N 1.34 0.178 0 CA-C-N 118.028 0.377 . . . . 0.0 110.035 179.272 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 84.2 p -50.87 -38.42 49.35 Favored 'General case' 0 C--N 1.342 0.268 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 -179.325 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 58.1 m170 -50.22 -39.82 45.58 Favored 'General case' 0 CA--C 1.529 0.166 0 O-C-N 123.266 0.353 . . . . 0.0 110.227 178.344 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 3.7 t -84.81 -53.97 9.65 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.167 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.032 -178.679 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 31.6 mm -55.22 -50.33 65.25 Favored 'Isoleucine or valine' 0 C--N 1.343 0.307 0 O-C-N 122.797 0.061 . . . . 0.0 110.918 -175.788 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 25.5 t30 -82.42 -3.2 55.21 Favored 'General case' 0 CA--C 1.533 0.305 0 N-CA-C 110.175 -0.306 . . . . 0.0 110.175 -178.498 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 52.8 mtmt 55.19 37.82 29.48 Favored 'General case' 0 C--N 1.347 0.466 0 N-CA-C 108.839 -0.801 . . . . 0.0 108.839 -178.294 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.9 -32.47 73.74 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 115.567 -0.742 . . . . 0.0 109.885 -178.877 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 15.6 ptp180 -157.48 145.05 18.69 Favored 'General case' 0 N--CA 1.452 -0.362 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 179.007 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 30.8 t80 -79.66 92.12 5.33 Favored 'General case' 0 N--CA 1.455 -0.214 0 N-CA-C 109.752 -0.462 . . . . 0.0 109.752 -178.812 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 11.7 m -72.75 163.58 3.88 Favored 'Isoleucine or valine' 0 C--O 1.233 0.22 0 N-CA-C 109.92 -0.4 . . . . 0.0 109.92 178.845 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -65.35 157.03 30.32 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 178.142 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -53.92 -38.02 64.42 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 122.575 0.35 . . . . 0.0 110.415 -179.946 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -68.14 -12.4 60.84 Favored 'General case' 0 CA--C 1.538 0.518 0 N-CA-C 112.172 0.434 . . . . 0.0 112.172 -177.432 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -94.67 -52.31 4.34 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 118.343 0.52 . . . . 0.0 109.9 179.546 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 6.6 ptm180 -69.45 -35.28 75.49 Favored 'General case' 0 CA--C 1.53 0.2 0 N-CA-C 112.02 0.378 . . . . 0.0 112.02 -176.645 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 43.2 p-10 -57.59 -38.62 75.2 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 118.202 0.456 . . . . 0.0 110.162 -179.214 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.41 -43.09 91.64 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 110.32 -0.252 . . . . 0.0 110.32 -179.86 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 87.4 t -60.51 -59.66 3.81 Favored 'Isoleucine or valine' 0 C--N 1.339 0.15 0 N-CA-C 110.105 -0.332 . . . . 0.0 110.105 -179.466 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 52.5 m95 -60.47 -37.28 80.52 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 116.718 -0.219 . . . . 0.0 110.942 -177.549 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -63.49 -58.2 7.77 Favored 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 178.895 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -52.39 -45.17 65.71 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 122.304 0.242 . . . . 0.0 110.766 -178.745 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 36.1 mt -54.7 -30.13 21.98 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 C-N-CA 122.245 0.218 . . . . 0.0 111.041 -179.437 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 7.7 mtpm? -85.11 -53.61 5.16 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 110.047 -0.353 . . . . 0.0 110.047 -178.676 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -63.98 -55.86 19.32 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.657 -175.425 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -73.87 -3.23 27.56 Favored 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 179.556 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 37.0 p-80 40.62 84.18 0.02 OUTLIER 'General case' 0 C--N 1.353 0.741 0 C-N-CA 124.036 0.934 . . . . 0.0 111.556 179.291 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 13.3 t80 -56.69 108.12 0.46 Allowed 'General case' 0 N--CA 1.456 -0.154 0 CA-C-N 115.527 -0.76 . . . . 0.0 109.166 178.963 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 30.5 t -165.65 85.13 1.01 Allowed Pre-proline 0 N--CA 1.451 -0.396 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 -179.028 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 3.5 Cg_exo -62.97 120.47 7.97 Favored 'Trans proline' 0 N--CA 1.447 -1.245 0 C-N-CA 122.639 2.226 . . . . 0.0 110.663 -179.906 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 11.5 p -74.42 -43.32 56.82 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 178.313 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -88.58 -171.01 3.16 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 178.782 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.427 HG22 ' O ' ' A' ' 50' ' ' VAL . 12.2 p 42.01 40.91 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.789 0 C-N-CA 123.524 0.73 . . . . 0.0 110.872 179.643 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -95.85 -55.44 2.99 Favored 'General case' 0 C--N 1.341 0.234 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 179.718 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 4.8 ppt_? -66.8 -27.85 67.9 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 116.587 -0.279 . . . . 0.0 110.436 179.698 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 49.5 m -78.84 130.6 35.87 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 109.341 -0.615 . . . . 0.0 109.341 179.538 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -74.22 88.74 2.0 Allowed 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 -179.647 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 30.4 tptt -148.69 124.63 10.63 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 179.643 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 27.7 m . . . . . 0 C--O 1.25 1.081 0 CA-C-O 116.317 -1.801 . . . . 0.0 108.714 178.348 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.5 tmm? . . . . . 0 N--CA 1.472 0.664 0 N-CA-C 110.034 -0.358 . . . . 0.0 110.034 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -67.26 96.69 0.49 Allowed 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 109.727 -0.472 . . . . 0.0 109.727 179.344 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 21.8 p -142.42 -77.89 0.25 Allowed 'General case' 0 N--CA 1.452 -0.353 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 -179.852 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 19.5 tt -140.44 -32.77 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.174 0 C-N-CA 123.009 0.524 . . . . 0.0 109.707 178.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 26.7 mmtp -67.35 -62.96 1.17 Allowed 'General case' 0 N--CA 1.445 -0.69 0 C-N-CA 122.785 0.434 . . . . 0.0 110.962 -179.425 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 65.7 m-20 -69.04 -42.83 75.82 Favored 'General case' 0 N--CA 1.461 0.105 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.798 -175.764 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.522 HG23 ' H ' ' A' ' 8' ' ' ALA . 18.7 m -53.31 -56.6 7.55 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.191 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 -179.905 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.522 ' H ' HG23 ' A' ' 7' ' ' VAL . . . -59.12 -45.88 89.78 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 122.988 0.515 . . . . 0.0 110.857 179.419 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 2.0 ttmp? -53.57 -49.74 67.05 Favored 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 110.178 -0.305 . . . . 0.0 110.178 -179.101 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 57.6 ttt85 -71.67 -37.81 70.72 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 122.371 0.268 . . . . 0.0 110.645 -179.007 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -60.53 -40.17 90.55 Favored 'General case' 0 N--CA 1.456 -0.168 0 C-N-CA 122.257 0.223 . . . . 0.0 110.793 -178.595 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 23.8 t-20 -140.79 -88.36 0.17 Allowed 'General case' 0 C--N 1.343 0.325 0 N-CA-C 110.461 -0.2 . . . . 0.0 110.461 -179.418 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 71.5 t -139.47 -57.35 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.345 0.38 0 N-CA-C 109.835 -0.432 . . . . 0.0 109.835 -178.266 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 67.1 m -152.44 176.34 11.77 Favored 'General case' 0 C--N 1.344 0.339 0 N-CA-C 109.872 -0.418 . . . . 0.0 109.872 -179.342 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 17.2 p -63.52 -20.59 65.74 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.103 -179.637 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 14.9 t -53.79 -38.82 64.89 Favored 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 109.999 -0.371 . . . . 0.0 109.999 179.601 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 18.0 m -61.47 -42.47 98.83 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 109.819 -0.438 . . . . 0.0 109.819 179.463 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 20.6 t -65.72 -35.63 75.65 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.14 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 179.356 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 23.1 t -65.28 -43.59 90.69 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 72.7 m-70 -64.16 -43.22 95.85 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.285 179.38 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 16.2 t -55.72 -47.17 79.58 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.28 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 179.123 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 60.3 mt -61.63 -48.46 88.66 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 29.4 m-80 -75.28 -9.97 59.04 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 122.167 0.187 . . . . 0.0 111.119 -179.245 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 4.8 tmtp? 62.38 42.97 8.51 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 122.893 0.477 . . . . 0.0 110.012 -179.881 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -98.24 -84.4 0.39 Allowed 'General case' 0 C--N 1.344 0.357 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 179.762 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 67.1 mtp180 -97.11 120.5 37.58 Favored 'General case' 0 N--CA 1.456 -0.126 0 N-CA-C 109.496 -0.557 . . . . 0.0 109.496 -179.792 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 29.2 p90 -149.77 120.78 7.7 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 179.234 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 3.8 t -81.76 75.97 0.96 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.396 0 N-CA-C 107.856 -1.164 . . . . 0.0 107.856 179.048 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 65.11 -178.89 0.18 Allowed 'General case' 0 C--O 1.236 0.348 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.094 -178.352 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 -65.29 -25.1 67.49 Favored 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 110.214 -0.291 . . . . 0.0 110.214 -179.197 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -52.09 -39.13 59.31 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 122.565 0.346 . . . . 0.0 110.813 179.438 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 99.0 m -59.07 -67.41 0.37 Allowed 'General case' 0 C--N 1.343 0.287 0 N-CA-C 110.439 -0.208 . . . . 0.0 110.439 -179.581 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 9.9 ptm180 -56.5 -39.13 72.77 Favored 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 110.581 -0.155 . . . . 0.0 110.581 -177.836 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -59.7 -57.39 13.12 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 110.305 -0.257 . . . . 0.0 110.305 -179.443 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -59.81 -42.25 93.06 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 122.429 0.292 . . . . 0.0 110.649 -179.102 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 21.3 t -58.39 -61.13 1.5 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.2 0 C-N-CA 122.365 0.266 . . . . 0.0 110.324 -179.216 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 19.5 m95 -61.63 -38.22 86.86 Favored 'General case' 0 N--CA 1.455 -0.177 0 N-CA-C 110.687 -0.116 . . . . 0.0 110.687 -178.145 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -59.65 -51.42 69.89 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 109.863 -0.421 . . . . 0.0 109.863 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -61.38 -46.94 88.1 Favored 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 122.29 0.236 . . . . 0.0 110.64 -179.38 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 55.5 mt -58.18 -41.83 81.82 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.295 0 C-N-CA 122.229 0.211 . . . . 0.0 110.496 -179.22 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 37.6 ttmt -74.2 -38.81 63.5 Favored 'General case' 0 N--CA 1.45 -0.449 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 -178.067 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -62.66 -52.83 61.78 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-N 116.564 -0.289 . . . . 0.0 110.455 -178.153 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 10.2 mp -79.24 -18.16 53.38 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-O 119.554 -0.26 . . . . 0.0 110.47 -179.061 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 22.2 m80 76.17 137.62 0.06 Allowed 'General case' 0 C--N 1.348 0.509 0 C-N-CA 123.871 0.868 . . . . 0.0 110.966 178.299 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 8.1 t80 -110.34 101.27 10.02 Favored 'General case' 0 CA--C 1.529 0.158 0 N-CA-C 108.466 -0.939 . . . . 0.0 108.466 178.729 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . 0.439 ' CB ' ' HD3' ' A' ' 47' ' ' PRO . 1.1 m -60.22 -64.7 2.74 Favored Pre-proline 0 CA--C 1.544 0.724 0 CA-C-O 118.691 -0.671 . . . . 0.0 111.061 -177.587 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . 0.439 ' HD3' ' CB ' ' A' ' 46' ' ' SER . 8.6 Cg_exo -54.18 148.75 39.06 Favored 'Trans proline' 0 C--N 1.36 1.16 0 C-N-CA 121.856 1.704 . . . . 0.0 110.757 178.368 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 20.9 t -69.19 168.35 14.28 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 116.482 -0.327 . . . . 0.0 110.695 -178.819 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -60.33 -52.21 66.23 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-N 116.234 -0.439 . . . . 0.0 109.95 179.761 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 33.0 m -91.29 143.6 10.91 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.241 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 179.793 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -72.38 -48.19 43.57 Favored 'General case' 0 N--CA 1.455 -0.178 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 179.435 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 37.2 ttp85 -153.53 50.52 0.69 Allowed 'General case' 0 CA--C 1.531 0.218 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 179.688 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 27.2 m 49.88 47.42 23.17 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 122.68 0.392 . . . . 0.0 110.257 -179.796 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -66.46 -52.7 43.44 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 -179.571 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 56.8 mtpt 55.5 -121.22 1.68 Allowed 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 109.57 -0.53 . . . . 0.0 109.57 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 14.2 p . . . . . 0 C--O 1.251 1.149 0 CA-C-O 116.776 -1.583 . . . . 0.0 108.968 179.954 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.0 mpp? . . . . . 0 N--CA 1.479 1.021 0 N-CA-C 109.869 -0.419 . . . . 0.0 109.869 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -163.53 -79.12 0.03 OUTLIER 'General case' 0 C--N 1.345 0.37 0 CA-C-O 119.788 -0.149 . . . . 0.0 110.644 179.274 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 3.9 t 178.01 -42.52 0.01 OUTLIER 'General case' 0 C--N 1.349 0.545 0 C-N-CA 122.601 0.361 . . . . 0.0 110.244 -176.988 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 7.1 tt -146.34 -20.56 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.85 0 N-CA-C 111.836 0.31 . . . . 0.0 111.836 -177.956 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 15.6 tppt? -48.01 -70.26 0.1 Allowed 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 123.552 0.741 . . . . 0.0 112.293 -178.11 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 69.1 m-20 -63.07 -40.19 96.95 Favored 'General case' 0 C--O 1.221 -0.399 0 CA-C-O 119.787 -0.149 . . . . 0.0 110.711 -175.579 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.431 HG23 ' CD2' ' A' ' 45' ' ' TYR . 2.4 t -52.17 -46.35 43.86 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.175 0 C-N-CA 122.166 0.187 . . . . 0.0 110.785 -179.111 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -52.61 -61.36 2.33 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 110.584 -0.154 . . . . 0.0 110.584 -178.578 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -68.38 -28.21 66.91 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-O 119.791 -0.147 . . . . 0.0 111.347 -177.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 1.6 tpm_? -62.01 -48.0 82.23 Favored 'General case' 0 C--N 1.339 0.146 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 179.212 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -78.49 -1.07 32.01 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 110.068 -0.345 . . . . 0.0 110.068 178.033 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 7.7 t-20 61.13 48.06 6.67 Favored 'General case' 0 C--N 1.348 0.501 0 C-N-CA 123.613 0.765 . . . . 0.0 110.828 178.8 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 30.3 m -146.43 148.01 17.45 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.221 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 177.671 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 69.2 m -63.91 154.76 32.85 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 109.762 -0.459 . . . . 0.0 109.762 179.604 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 15.0 t -53.81 -32.72 53.76 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 116.576 -0.283 . . . . 0.0 110.364 179.484 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 3.7 m -57.07 -43.0 81.66 Favored 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 178.891 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 6.1 m -63.06 -40.79 98.72 Favored 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 179.527 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 47.1 t -64.05 -39.05 84.07 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.238 0 N-CA-C 109.333 -0.618 . . . . 0.0 109.333 179.417 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 10.0 t -55.99 -37.64 69.38 Favored 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 110.129 -0.323 . . . . 0.0 110.129 179.337 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 43.0 m170 -61.27 -33.61 73.83 Favored 'General case' 0 C--N 1.341 0.237 0 N-CA-C 110.261 -0.274 . . . . 0.0 110.261 179.704 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 90.8 t -74.56 -41.41 48.8 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.099 0 C-N-CA 122.182 0.193 . . . . 0.0 110.886 -178.969 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 72.4 mt -49.23 -55.05 4.52 Favored 'Isoleucine or valine' 0 C--N 1.343 0.298 0 C-N-CA 122.297 0.239 . . . . 0.0 110.958 -176.828 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 5.8 p30 -104.8 13.31 31.51 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 117.558 0.163 . . . . 0.0 110.825 -178.36 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 65.1 mttt 46.9 58.57 4.63 Favored 'General case' 0 C--N 1.346 0.421 0 C-N-CA 122.829 0.452 . . . . 0.0 110.64 179.268 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -72.49 -65.98 0.72 Allowed 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 -179.528 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 84.1 mtt85 -94.04 129.06 40.7 Favored 'General case' 0 C--N 1.342 0.274 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 -179.608 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -77.14 111.12 12.41 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 109.37 -0.604 . . . . 0.0 109.37 179.942 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 9.5 m -110.03 43.31 0.27 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 CA-C-N 115.806 -0.633 . . . . 0.0 109.479 -178.881 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.416 ' C ' ' H ' ' A' ' 31' ' ' GLU . . . 54.79 22.69 4.34 Favored 'General case' 0 C--N 1.345 0.379 0 C-N-CA 123.565 0.746 . . . . 0.0 112.16 178.52 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 70.6 mm-40 65.82 -26.65 0.1 Allowed 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 124.052 0.941 . . . . 0.0 113.096 178.661 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.416 ' H ' ' C ' ' A' ' 29' ' ' ALA . 40.8 tt0 -48.11 -58.93 3.82 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 118.547 0.612 . . . . 0.0 110.879 -178.528 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 7.9 m -64.64 -39.63 94.03 Favored 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 110.744 -0.095 . . . . 0.0 110.744 -178.512 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 92.2 mtt180 -57.97 -52.89 63.63 Favored 'General case' 0 CA--C 1.533 0.299 0 N-CA-C 110.129 -0.323 . . . . 0.0 110.129 -179.327 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -63.72 -37.95 89.27 Favored 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 110.066 -0.346 . . . . 0.0 110.066 -179.232 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -60.63 -42.54 97.11 Favored 'General case' 0 C--N 1.341 0.205 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 179.051 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 20.6 t -65.59 -45.08 93.39 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 179.014 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 15.4 m95 -61.63 -33.75 74.47 Favored 'General case' 0 CA--C 1.531 0.244 0 N-CA-C 109.895 -0.409 . . . . 0.0 109.895 179.145 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -67.58 -42.96 81.7 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 109.033 -0.728 . . . . 0.0 109.033 177.365 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.64 -38.67 78.61 Favored 'General case' 0 C--N 1.345 0.393 0 N-CA-C 110.001 -0.37 . . . . 0.0 110.001 178.884 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -54.65 -44.88 71.65 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 179.367 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 15.0 mttm -94.99 12.55 28.05 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-O 119.655 -0.212 . . . . 0.0 111.313 -178.467 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -79.32 -48.86 13.36 Favored 'General case' 0 N--CA 1.456 -0.168 0 N-CA-C 108.647 -0.872 . . . . 0.0 108.647 178.917 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -92.99 -94.03 0.15 Allowed 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 178.709 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 99.7 m-70 -159.79 26.41 0.18 Allowed 'General case' 0 C--N 1.343 0.286 0 C-N-CA 123.232 0.613 . . . . 0.0 109.533 -178.322 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.431 ' CD2' HG23 ' A' ' 7' ' ' VAL . 2.5 m-85 -80.84 153.36 27.71 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.989 0.423 . . . . 0.0 110.036 -177.931 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 22.2 p -167.21 76.6 1.01 Allowed Pre-proline 0 CA--C 1.536 0.412 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 -179.711 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -58.1 -47.38 20.46 Favored 'Trans proline' 0 N--CA 1.45 -1.067 0 C-N-CA 122.639 2.226 . . . . 0.0 111.024 -178.397 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 18.6 m -80.17 53.75 1.81 Allowed 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 110.229 -0.285 . . . . 0.0 110.229 -179.595 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -167.93 -56.01 0.02 OUTLIER 'General case' 0 N--CA 1.456 -0.174 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 179.625 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 9.9 p -65.34 128.51 28.24 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.27 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 -179.548 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -169.24 -58.55 0.02 OUTLIER 'General case' 0 C--N 1.342 0.242 0 N-CA-C 109.36 -0.607 . . . . 0.0 109.36 -179.674 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 44.4 ttm-85 57.63 45.87 18.45 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 122.787 0.435 . . . . 0.0 110.077 -179.829 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 16.6 m -70.46 139.4 51.72 Favored 'General case' 0 C--O 1.237 0.42 0 N-CA-C 109.765 -0.457 . . . . 0.0 109.765 179.772 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 2.3 pp -63.8 157.55 24.17 Favored 'General case' 0 C--N 1.341 0.229 0 N-CA-C 109.934 -0.395 . . . . 0.0 109.934 179.534 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 47.2 mmtt -95.59 -43.06 8.11 Favored 'General case' 0 CA--C 1.528 0.113 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 -178.829 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 14.6 p . . . . . 0 C--O 1.255 1.355 0 CA-C-O 116.495 -1.716 . . . . 0.0 108.997 179.686 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.474 0.773 0 CA-C-O 120.879 0.371 . . . . 0.0 110.683 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -79.07 63.92 3.86 Favored 'General case' 0 C--N 1.342 0.277 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 179.578 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 5.2 m -126.46 50.03 1.96 Allowed 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 108.52 -0.918 . . . . 0.0 108.52 -178.975 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER 80.53 -23.88 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.465 0 C-N-CA 124.484 1.114 . . . . 0.0 110.429 -179.688 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -66.97 -66.03 0.61 Allowed 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 122.568 0.347 . . . . 0.0 110.252 -179.812 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 91.3 m-20 -65.55 -39.0 91.23 Favored 'General case' 0 C--O 1.227 -0.084 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 84.7 t -55.52 -44.25 75.57 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.235 0 C-N-CA 122.673 0.389 . . . . 0.0 110.176 -179.487 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -57.6 -47.07 83.16 Favored 'General case' 0 C--N 1.34 0.187 0 C-N-CA 122.044 0.137 . . . . 0.0 110.707 -179.294 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 6.3 mmmm -67.09 -41.12 86.84 Favored 'General case' 0 N--CA 1.457 -0.089 0 N-CA-C 109.773 -0.454 . . . . 0.0 109.773 179.912 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 45.0 ttt85 -59.52 -35.79 74.86 Favored 'General case' 0 N--CA 1.452 -0.351 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 179.131 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -75.89 -56.93 4.2 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 110.029 -0.359 . . . . 0.0 110.029 179.556 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -164.15 -93.73 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 119.82 -0.133 . . . . 0.0 111.276 -179.151 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 5.0 m -97.94 -118.63 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 C-N-CA 122.232 0.213 . . . . 0.0 110.867 -176.248 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 89.5 p -105.98 -175.09 2.7 Favored 'General case' 0 C--N 1.344 0.36 0 C-N-CA 122.621 0.368 . . . . 0.0 110.327 -176.981 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 76.8 p -55.83 -23.83 32.81 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.215 -178.398 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.4 HG23 ' N ' ' A' ' 17' ' ' THR . 13.2 t -51.62 -44.83 63.05 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 117.724 0.238 . . . . 0.0 110.426 -179.898 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . 0.4 ' N ' HG23 ' A' ' 16' ' ' THR . 2.4 m -64.92 -47.91 76.04 Favored 'General case' 0 C--N 1.341 0.219 0 N-CA-C 110.301 -0.259 . . . . 0.0 110.301 -179.453 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 54.6 t -58.4 -44.84 89.52 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.169 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 -179.47 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 56.3 m -60.91 -45.81 93.18 Favored 'General case' 0 C--O 1.22 -0.496 0 N-CA-C 110.013 -0.365 . . . . 0.0 110.013 179.489 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 34.7 m170 -58.31 -41.58 84.78 Favored 'General case' 0 C--N 1.339 0.148 0 N-CA-C 110.292 -0.262 . . . . 0.0 110.292 -179.608 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 42.4 t -65.88 -55.93 17.17 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.257 0 O-C-N 123.085 0.241 . . . . 0.0 110.688 -178.939 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 92.6 mt -64.02 -53.34 45.12 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 N-CA-C 110.299 -0.26 . . . . 0.0 110.299 -177.69 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 19.4 t-20 -62.32 -30.66 71.31 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 122.624 0.37 . . . . 0.0 110.581 -179.237 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 41.2 tttp 71.45 53.09 0.23 Allowed 'General case' 0 C--N 1.344 0.342 0 C-N-CA 122.915 0.486 . . . . 0.0 109.735 179.816 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 26.6 p -75.71 -64.57 1.05 Allowed 'General case' 0 C--N 1.34 0.154 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 179.39 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 48.6 ttp85 -128.89 134.23 48.2 Favored 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 179.629 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 54.6 p90 -64.85 143.19 58.11 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 179.749 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 30.1 m -110.27 170.42 3.28 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.147 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 179.529 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -80.3 51.35 1.4 Allowed 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 122.402 0.281 . . . . 0.0 111.213 -177.728 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 63.79 -68.68 0.09 Allowed 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.249 1.02 . . . . 0.0 112.746 177.835 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 56.5 mm-40 -37.4 -53.5 1.12 Allowed 'General case' 0 C--N 1.34 0.162 0 C-N-CA 123.729 0.812 . . . . 0.0 112.076 -175.042 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 8.2 m -60.05 -52.04 67.07 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 116.983 -0.098 . . . . 0.0 111.015 -177.47 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 11.8 ttp85 -60.89 -47.47 86.24 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 122.26 0.224 . . . . 0.0 110.64 -178.58 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 20.5 m-80 -61.69 -41.18 97.22 Favored 'General case' 0 N--CA 1.456 -0.158 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 -179.788 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -60.79 -40.62 93.3 Favored 'General case' 0 C--N 1.34 0.185 0 N-CA-C 110.158 -0.312 . . . . 0.0 110.158 179.852 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 38.0 t -64.09 -53.79 39.39 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.199 0 N-CA-C 109.6 -0.518 . . . . 0.0 109.6 179.439 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 13.5 m95 -59.82 -33.92 72.39 Favored 'General case' 0 C--O 1.233 0.229 0 N-CA-C 110.615 -0.143 . . . . 0.0 110.615 -179.202 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -70.37 -57.85 4.38 Favored 'General case' 0 C--O 1.224 -0.286 0 N-CA-C 109.789 -0.449 . . . . 0.0 109.789 179.401 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -50.09 -44.19 51.81 Favored 'General case' 0 C--N 1.341 0.203 0 C-N-CA 122.94 0.496 . . . . 0.0 111.066 -179.082 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 13.8 mt -51.36 -40.92 24.62 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 C-N-CA 122.977 0.511 . . . . 0.0 111.046 -179.36 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 41.2 mttp -98.03 -20.0 17.66 Favored 'General case' 0 C--N 1.344 0.328 0 N-CA-C 111.567 0.21 . . . . 0.0 111.567 -177.13 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -73.17 -50.04 24.8 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 109.106 -0.702 . . . . 0.0 109.106 -178.089 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 51.6 tp -77.64 -92.0 0.03 OUTLIER 'General case' 0 N--CA 1.446 -0.642 0 N-CA-C 108.153 -1.054 . . . . 0.0 108.153 177.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 4.0 p-80 165.3 75.87 0.0 OUTLIER 'General case' 0 C--N 1.341 0.233 0 C-N-CA 123.759 0.824 . . . . 0.0 108.996 179.781 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 15.6 t80 -70.0 136.78 50.78 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.118 -0.492 . . . . 0.0 109.776 -179.411 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 19.9 p -117.96 96.59 49.81 Favored Pre-proline 0 CA--C 1.537 0.446 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 178.814 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 10.9 Cg_endo -71.96 72.78 2.6 Favored 'Trans proline' 0 N--CA 1.449 -1.092 0 C-N-CA 122.68 2.253 . . . . 0.0 110.184 179.031 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 19.5 m -60.01 -35.34 74.85 Favored 'General case' 0 CA--C 1.529 0.14 0 C-N-CA 122.442 0.297 . . . . 0.0 110.271 -179.827 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -57.02 -38.43 73.12 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 122.455 0.302 . . . . 0.0 110.405 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 11.2 t -128.77 65.56 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.342 0.262 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 -179.925 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -75.06 -63.85 1.18 Allowed 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 109.554 -0.536 . . . . 0.0 109.554 179.74 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 18.9 ttm180 -165.07 -141.27 0.05 OUTLIER 'General case' 0 N--CA 1.451 -0.379 0 N-CA-C 108.532 -0.914 . . . . 0.0 108.532 179.312 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 42.7 t -103.24 -52.05 3.11 Favored 'General case' 0 C--N 1.338 0.077 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 -179.897 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -94.65 -171.52 2.5 Favored 'General case' 0 CA--C 1.536 0.409 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 -179.722 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 4.4 ttpt -68.35 -38.5 81.53 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 122.417 0.287 . . . . 0.0 110.693 -178.398 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 33.0 t . . . . . 0 C--O 1.25 1.099 0 CA-C-O 117.292 -1.337 . . . . 0.0 109.98 -178.981 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.478 0.974 0 CA-C-O 119.693 -0.194 . . . . 0.0 111.4 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -53.57 -77.93 0.02 OUTLIER 'General case' 0 C--N 1.352 0.69 0 N-CA-C 110.203 -0.295 . . . . 0.0 110.203 -179.276 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 3.2 m 64.23 167.75 0.16 Allowed 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 122.667 0.387 . . . . 0.0 110.686 177.564 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER 77.75 -40.79 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.528 0 C-N-CA 124.228 1.011 . . . . 0.0 108.734 -177.856 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 62.9 mttp -69.68 -60.97 1.98 Allowed 'General case' 0 N--CA 1.446 -0.64 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 177.586 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -63.91 -51.49 64.25 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 115.683 -0.69 . . . . 0.0 109.502 178.619 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 76.5 t -45.65 -47.1 4.79 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.225 0 C-N-CA 123.121 0.569 . . . . 0.0 111.707 -177.399 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -53.86 -62.46 1.64 Allowed 'General case' 0 C--O 1.223 -0.313 0 CA-C-N 117.511 0.142 . . . . 0.0 111.333 -177.78 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 21.7 mmmt -68.45 -44.11 75.6 Favored 'General case' 0 C--N 1.331 -0.232 0 O-C-N 122.45 -0.156 . . . . 0.0 110.988 -176.874 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 16.3 tpp180 -57.82 -39.82 78.52 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 122.568 0.347 . . . . 0.0 110.7 -178.467 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -98.22 12.86 33.26 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-O 119.562 -0.256 . . . . 0.0 110.825 -179.384 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . 0.912 ' O ' HG22 ' A' ' 13' ' ' VAL . 48.6 t30 75.52 150.83 0.12 Allowed 'General case' 0 C--N 1.35 0.589 0 C-N-CA 123.684 0.793 . . . . 0.0 110.147 179.945 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.912 HG22 ' O ' ' A' ' 12' ' ' ASN . 2.2 m 82.94 175.1 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.479 0.982 0 C-N-CA 125.679 1.591 . . . . 0.0 110.315 -179.609 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 22.4 t -96.91 -178.06 4.09 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.501 -177.623 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 19.1 p -69.0 -45.17 71.25 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.383 -179.048 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 11.9 t -56.22 -41.93 76.45 Favored 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 110.46 -0.2 . . . . 0.0 110.46 -179.121 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -65.3 -28.28 69.21 Favored 'General case' 0 CA--C 1.53 0.202 0 O-C-N 122.24 -0.287 . . . . 0.0 110.34 179.893 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 65.8 t -76.59 -37.89 30.21 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.199 0 N-CA-C 108.496 -0.927 . . . . 0.0 108.496 176.707 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 19.6 m -58.71 -33.08 69.79 Favored 'General case' 0 CA--C 1.531 0.226 0 N-CA-C 109.989 -0.374 . . . . 0.0 109.989 178.521 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 51.4 m170 -56.13 -39.35 72.1 Favored 'General case' 0 C--N 1.345 0.381 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 178.398 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 56.4 t -68.02 -46.36 81.87 Favored 'Isoleucine or valine' 0 C--N 1.341 0.211 0 N-CA-C 109.786 -0.45 . . . . 0.0 109.786 179.66 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 72.7 mt -58.87 -39.57 77.82 Favored 'Isoleucine or valine' 0 C--O 1.234 0.253 0 N-CA-C 109.835 -0.431 . . . . 0.0 109.835 -179.236 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 34.5 m-80 -93.77 15.35 16.67 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 122.369 0.267 . . . . 0.0 110.282 179.436 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 30.15 65.39 0.14 Allowed 'General case' 0 C--N 1.356 0.868 0 C-N-CA 124.376 1.07 . . . . 0.0 111.566 -179.357 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 17.4 p -104.44 -83.7 0.49 Allowed 'General case' 0 C--N 1.342 0.24 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 178.208 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 14.4 tpt180 -90.81 105.29 17.72 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 108.936 -0.764 . . . . 0.0 108.936 179.212 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 40.7 t80 -78.26 100.45 6.69 Favored 'General case' 0 N--CA 1.454 -0.227 0 N-CA-C 109.705 -0.48 . . . . 0.0 109.705 -179.738 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 4.3 t -87.28 57.4 0.17 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.42 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 -179.917 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 65.26 176.25 0.21 Allowed 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 123.233 0.613 . . . . 0.0 111.489 178.933 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 48.1 mp0 -68.9 -25.74 64.75 Favored 'General case' 0 C--O 1.219 -0.509 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.009 -179.273 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 20.6 tp10 -53.81 -60.26 3.55 Favored 'General case' 0 C--O 1.226 -0.165 0 C-N-CA 122.559 0.344 . . . . 0.0 111.263 -176.982 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 63.1 p -61.83 -44.75 96.21 Favored 'General case' 0 C--O 1.224 -0.272 0 N-CA-C 110.003 -0.369 . . . . 0.0 110.003 -178.555 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 64.7 ttp85 -56.37 -60.19 3.87 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 122.41 0.284 . . . . 0.0 111.284 -178.192 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -67.01 -39.91 87.17 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-O 119.603 -0.236 . . . . 0.0 111.08 -175.231 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -62.8 -45.13 94.06 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 117.881 0.309 . . . . 0.0 110.409 -179.777 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 20.3 t -60.63 -57.25 12.82 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.108 0 C-N-CA 122.299 0.24 . . . . 0.0 110.646 -178.802 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 14.9 m95 -60.14 -38.04 81.89 Favored 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 110.77 -0.085 . . . . 0.0 110.77 -178.151 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -63.25 -53.23 56.28 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 -179.933 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -60.3 -40.49 90.72 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-N 116.569 -0.287 . . . . 0.0 110.636 -179.139 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 14.3 mt -59.53 -44.53 93.27 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.146 0 N-CA-C 110.232 -0.284 . . . . 0.0 110.232 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 57.8 tptt -70.27 -35.28 73.65 Favored 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 -178.59 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -66.74 -52.87 39.27 Favored 'General case' 0 N--CA 1.443 -0.798 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.041 -177.98 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 10.5 mp -81.78 -21.05 38.0 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 122.348 0.259 . . . . 0.0 111.305 -177.456 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 2.4 m-70 71.73 110.66 0.06 Allowed 'General case' 0 N--CA 1.465 0.317 0 N-CA-C 108.636 -0.876 . . . . 0.0 108.636 -177.032 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -103.78 108.36 19.63 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 122.83 0.452 . . . . 0.0 110.387 -176.522 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 55.8 p -89.53 116.73 67.08 Favored Pre-proline 0 CA--C 1.536 0.425 0 N-CA-C 108.323 -0.992 . . . . 0.0 108.323 176.753 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -70.68 79.26 1.25 Allowed 'Trans proline' 0 N--CA 1.452 -0.917 0 C-N-CA 122.313 2.009 . . . . 0.0 110.903 -178.434 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 23.3 t 48.14 45.86 19.65 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 122.813 0.445 . . . . 0.0 110.69 178.873 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -154.0 95.21 1.83 Allowed 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 109.743 -0.466 . . . . 0.0 109.743 -179.43 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 33.9 m -69.04 152.46 9.48 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.231 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 179.466 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -153.0 84.73 1.21 Allowed 'General case' 0 N--CA 1.453 -0.317 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 -179.777 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 42.9 ttt85 57.98 42.75 22.28 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 -179.357 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 27.8 p -79.26 71.26 5.78 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 179.658 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 72.2 mt -75.33 77.84 2.42 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 -179.739 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 47.0 mtmt 63.35 46.2 4.54 Favored 'General case' 0 C--N 1.342 0.267 0 C-N-CA 123.154 0.582 . . . . 0.0 109.949 -179.622 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 76.6 t . . . . . 0 C--O 1.248 0.984 0 CA-C-O 116.833 -1.556 . . . . 0.0 108.645 179.03 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 18.7 mmt . . . . . 0 N--CA 1.473 0.683 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -165.15 -171.94 2.37 Favored 'General case' 0 C--N 1.341 0.203 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 -179.592 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -135.01 -53.08 0.79 Allowed 'General case' 0 C--O 1.223 -0.336 0 N-CA-C 109.712 -0.477 . . . . 0.0 109.712 179.669 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 14.8 tt -177.19 -35.52 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.344 0.33 0 O-C-N 123.667 0.605 . . . . 0.0 109.802 -178.974 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 22.3 mtmm -48.33 -68.55 0.17 Allowed 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 123.657 0.783 . . . . 0.0 111.849 -177.587 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -52.23 -58.46 6.57 Favored 'General case' 0 C--O 1.219 -0.504 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.073 -177.667 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 63.1 t -50.22 -42.4 20.17 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.398 0 O-C-N 123.001 0.188 . . . . 0.0 111.197 -176.434 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -53.38 -62.86 1.38 Allowed 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 112.019 0.377 . . . . 0.0 112.019 -177.024 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 19.0 mtpp -79.1 -38.33 36.47 Favored 'General case' 0 N--CA 1.461 0.12 0 N-CA-C 110.618 -0.142 . . . . 0.0 110.618 -176.088 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 57.5 ttm-85 -57.6 -35.26 70.2 Favored 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 179.197 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -76.36 -60.82 2.17 Favored 'General case' 0 C--N 1.347 0.463 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 177.288 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 179.99 131.0 0.1 Allowed 'General case' 0 C--N 1.347 0.461 0 CA-C-O 120.686 0.279 . . . . 0.0 111.295 179.641 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 37.8 t 52.18 -94.52 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 C-N-CA 123.788 0.835 . . . . 0.0 111.497 176.31 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 66.9 m -149.96 -178.31 6.41 Favored 'General case' 0 C--N 1.344 0.364 0 CA-C-O 120.777 0.322 . . . . 0.0 110.368 -177.479 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 10.0 m -53.2 -35.26 59.68 Favored 'General case' 0 C--O 1.224 -0.259 0 C-N-CA 123.161 0.585 . . . . 0.0 110.975 -178.803 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 17.1 p -51.71 -46.86 64.1 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 122.46 0.304 . . . . 0.0 110.425 -179.29 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 24.9 m -65.62 -48.42 72.3 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 110.327 -0.249 . . . . 0.0 110.327 -178.907 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 87.5 t -60.38 -35.1 60.46 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.35 0 N-CA-C 110.242 -0.281 . . . . 0.0 110.242 -179.439 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 7.7 t -59.48 -45.06 92.72 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 109.983 -0.377 . . . . 0.0 109.983 -179.609 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 80.6 m-70 -58.49 -40.11 81.87 Favored 'General case' 0 N--CA 1.456 -0.135 0 O-C-N 122.996 0.185 . . . . 0.0 110.695 -179.021 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 52.9 t -56.27 -52.7 48.44 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.153 0 N-CA-C 110.003 -0.369 . . . . 0.0 110.003 -179.599 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 78.4 mt -66.04 -42.5 91.7 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 -179.415 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 37.8 t-20 -66.02 -20.92 66.34 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 122.973 0.509 . . . . 0.0 110.608 -179.545 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 74.3 tttt 66.24 50.98 1.29 Allowed 'General case' 0 C--N 1.343 0.289 0 C-N-CA 122.952 0.501 . . . . 0.0 109.655 -179.607 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -97.95 -82.89 0.41 Allowed 'General case' 0 C--N 1.341 0.212 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 179.665 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 19.0 ptp180 -87.36 154.17 20.89 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 179.792 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 50.5 t80 -123.83 145.39 49.11 Favored 'General case' 0 N--CA 1.456 -0.151 0 N-CA-C 109.886 -0.413 . . . . 0.0 109.886 -179.729 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.481 HG12 ' H ' ' A' ' 29' ' ' ALA . 2.9 t -134.97 172.87 15.35 Favored 'Isoleucine or valine' 0 C--O 1.231 0.114 0 N-CA-C 107.828 -1.175 . . . . 0.0 107.828 179.198 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.481 ' H ' HG12 ' A' ' 28' ' ' VAL . . . -48.08 149.52 1.41 Allowed 'General case' 0 C--O 1.235 0.331 0 N-CA-C 110.142 -0.318 . . . . 0.0 110.142 179.051 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 22.2 mp0 -51.3 -28.37 11.89 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.681 -179.225 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -57.02 -47.91 79.74 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 122.216 0.206 . . . . 0.0 110.499 179.624 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 10.4 m -64.82 -49.7 69.58 Favored 'General case' 0 C--N 1.344 0.359 0 N-CA-C 110.189 -0.3 . . . . 0.0 110.189 -178.74 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 38.4 mmt-85 -55.84 -50.64 70.0 Favored 'General case' 0 N--CA 1.455 -0.206 0 N-CA-C 109.785 -0.45 . . . . 0.0 109.785 -179.557 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -59.0 -48.49 81.38 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 122.552 0.341 . . . . 0.0 110.379 -179.613 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -57.83 -45.2 86.53 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 122.121 0.168 . . . . 0.0 110.678 -178.934 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 54.6 t -60.28 -57.24 12.73 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 N-CA-C 110.243 -0.28 . . . . 0.0 110.243 -178.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 41.4 m95 -60.63 -40.26 91.25 Favored 'General case' 0 CA--C 1.53 0.183 0 N-CA-C 110.735 -0.098 . . . . 0.0 110.735 -178.434 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -60.29 -53.14 61.24 Favored 'General case' 0 N--CA 1.453 -0.278 0 N-CA-C 109.722 -0.473 . . . . 0.0 109.722 179.69 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -56.41 -45.19 80.79 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 122.316 0.246 . . . . 0.0 110.493 -179.632 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 31.1 mt -56.18 -36.9 47.34 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.472 0 C-N-CA 122.256 0.223 . . . . 0.0 110.694 -179.314 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 6.3 mptp? -80.23 -45.6 17.71 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 -178.587 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 24.1 mm-40 -58.29 -47.4 83.78 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 122.48 0.312 . . . . 0.0 110.964 -178.052 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 6.0 mp -80.67 -1.8 44.01 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-O 119.611 -0.233 . . . . 0.0 110.777 -178.691 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 4.7 m-70 60.05 32.0 20.84 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 122.873 0.469 . . . . 0.0 110.905 178.454 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 10.2 t80 -61.79 135.26 57.52 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.438 -0.579 . . . . 0.0 109.438 179.237 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 40.3 t -159.39 118.78 1.69 Allowed Pre-proline 0 CA--C 1.533 0.294 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 -179.893 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 15.5 Cg_endo -72.93 71.17 3.48 Favored 'Trans proline' 0 N--CA 1.45 -1.03 0 C-N-CA 122.751 2.301 . . . . 0.0 109.864 179.219 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 10.6 p -80.18 -57.19 3.73 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 -179.226 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -81.26 51.17 1.56 Allowed 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 110.252 -0.277 . . . . 0.0 110.252 -179.81 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.54 ' O ' HG13 ' A' ' 50' ' ' VAL . 11.8 p -73.76 95.74 0.8 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.417 0 N-CA-C 109.754 -0.462 . . . . 0.0 109.754 -179.529 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 57.17 42.18 25.96 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.624 179.953 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 15.4 ptm180 -158.21 38.25 0.25 Allowed 'General case' 0 CA--C 1.532 0.288 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 179.021 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 14.7 m -63.83 118.32 8.19 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 -179.724 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 69.6 tp -65.47 121.93 16.02 Favored 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -139.63 -51.71 0.52 Allowed 'General case' 0 C--N 1.34 0.177 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 179.655 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 58.1 t . . . . . 0 C--O 1.252 1.211 0 CA-C-O 116.706 -1.616 . . . . 0.0 108.707 179.654 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.3 ptt? . . . . . 0 N--CA 1.472 0.651 0 N-CA-C 110.133 -0.321 . . . . 0.0 110.133 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 60.43 -173.91 0.12 Allowed 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 123.047 0.539 . . . . 0.0 110.651 -179.978 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . 0.734 HG22 ' H ' ' A' ' 4' ' ' ILE . 2.1 m 84.51 -176.75 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 124.2 1.0 . . . . 0.0 109.326 177.272 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.734 ' H ' HG22 ' A' ' 3' ' ' THR . 19.8 tt -49.06 -29.17 2.93 Favored 'Isoleucine or valine' 0 C--N 1.342 0.254 0 C-N-CA 122.525 0.33 . . . . 0.0 110.149 179.507 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 45.0 mtpt -57.01 -60.14 4.03 Favored 'General case' 0 N--CA 1.446 -0.625 0 C-N-CA 122.699 0.399 . . . . 0.0 110.475 179.059 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -70.19 -42.64 72.12 Favored 'General case' 0 N--CA 1.458 -0.068 0 N-CA-C 110.168 -0.308 . . . . 0.0 110.168 -177.683 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 54.8 t -55.01 -47.74 76.58 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.166 0 N-CA-C 110.188 -0.301 . . . . 0.0 110.188 -179.408 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -58.16 -54.98 40.86 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 122.349 0.26 . . . . 0.0 110.864 -178.455 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 27.0 tttt -65.79 -27.39 68.24 Favored 'General case' 0 CA--C 1.531 0.247 0 O-C-N 122.808 0.068 . . . . 0.0 110.908 -177.931 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.95 -36.22 69.82 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 177.759 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -78.19 -41.59 34.1 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.264 -178.427 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -155.12 -147.67 0.21 Allowed 'General case' 0 N--CA 1.449 -0.504 0 CA-C-O 120.841 0.353 . . . . 0.0 110.727 -177.321 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 62.0 t -71.44 -54.39 17.43 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.501 0 C-N-CA 123.012 0.525 . . . . 0.0 110.336 -178.804 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 50.8 m -155.49 -179.05 7.73 Favored 'General case' 0 C--N 1.346 0.42 0 CA-C-O 121.007 0.432 . . . . 0.0 110.806 -177.806 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.8 m -66.98 -3.26 6.67 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.158 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 16.6 p -57.83 -56.09 26.48 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 179.132 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -60.29 -33.86 72.95 Favored 'General case' 0 CA--C 1.537 0.442 0 N-CA-C 110.265 -0.272 . . . . 0.0 110.265 -179.268 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 58.1 t -64.51 -46.74 91.82 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.222 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 179.269 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 20.6 m -60.26 -43.28 96.28 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 178.753 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 48.5 m170 -58.19 -43.3 87.48 Favored 'General case' 0 C--O 1.221 -0.414 0 N-CA-C 109.867 -0.419 . . . . 0.0 109.867 179.357 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 7.3 t -68.2 -39.61 81.46 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 C-N-CA 122.351 0.26 . . . . 0.0 111.155 -179.045 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 40.3 mt -60.04 -59.14 4.48 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.395 0 CA-C-O 119.424 -0.322 . . . . 0.0 111.789 -176.521 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 2.4 p-10 -114.14 22.12 14.13 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-N 118.235 0.47 . . . . 0.0 112.1 -175.644 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 29.6 ttpt 55.22 46.04 24.58 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 122.313 0.245 . . . . 0.0 110.774 177.96 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -66.93 -35.33 79.75 Favored 'General case' 0 C--N 1.341 0.203 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 179.088 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 9.7 tpt180 -142.08 143.08 32.9 Favored 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 -179.89 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 63.8 t80 -68.03 137.11 54.8 Favored 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 -179.903 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 10.5 m -141.49 153.76 19.81 Favored 'Isoleucine or valine' 0 C--O 1.236 0.375 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 178.592 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -66.11 159.43 26.18 Favored 'General case' 0 N--CA 1.45 -0.438 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 179.273 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -52.18 -41.82 62.96 Favored 'General case' 0 CA--C 1.529 0.135 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 179.641 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 51.2 mt-10 -52.19 -47.37 65.59 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 123.039 0.536 . . . . 0.0 111.075 -179.165 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -61.05 -46.96 88.57 Favored 'General case' 0 C--N 1.341 0.208 0 N-CA-C 110.104 -0.332 . . . . 0.0 110.104 -178.704 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 27.6 ttm105 -58.43 -53.68 55.62 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.338 -178.875 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 29.2 m120 -60.68 -46.1 91.62 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 116.676 -0.238 . . . . 0.0 110.54 -179.275 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -56.63 -47.92 78.66 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 122.428 0.291 . . . . 0.0 110.782 -178.555 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 24.5 t -58.92 -56.64 15.55 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.196 0 N-CA-C 110.319 -0.252 . . . . 0.0 110.319 -179.108 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 20.6 m95 -59.91 -36.39 76.89 Favored 'General case' 0 C--N 1.341 0.201 0 O-C-N 122.568 -0.083 . . . . 0.0 110.888 -178.537 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -65.42 -51.65 58.8 Favored 'General case' 0 N--CA 1.456 -0.172 0 N-CA-C 110.051 -0.352 . . . . 0.0 110.051 179.894 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -57.51 -43.13 83.97 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 122.615 0.366 . . . . 0.0 110.776 -179.026 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 33.0 mt -56.85 -42.67 78.53 Favored 'Isoleucine or valine' 0 C--N 1.34 0.196 0 C-N-CA 122.205 0.202 . . . . 0.0 110.496 -179.447 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 37.0 mtmm -76.82 -36.49 56.87 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 110.024 -0.361 . . . . 0.0 110.024 -179.168 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -60.89 -60.95 2.98 Favored 'General case' 0 N--CA 1.451 -0.402 0 O-C-N 123.259 0.35 . . . . 0.0 110.924 -178.27 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -81.09 -18.69 45.68 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-O 119.624 -0.227 . . . . 0.0 111.268 -177.5 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 5.1 m-70 76.18 128.48 0.04 OUTLIER 'General case' 0 C--N 1.344 0.346 0 C-N-CA 123.411 0.685 . . . . 0.0 109.701 -178.567 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 6.7 t80 -81.97 74.11 8.97 Favored 'General case' 0 C--O 1.218 -0.592 0 N-CA-C 108.404 -0.961 . . . . 0.0 108.404 178.168 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . 0.515 ' CB ' ' CD ' ' A' ' 47' ' ' PRO . 9.6 m 8.38 -81.04 0.0 OUTLIER Pre-proline 0 CA--C 1.556 1.211 0 C-N-CA 125.34 1.456 . . . . 0.0 113.876 -178.326 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . 0.515 ' CD ' ' CB ' ' A' ' 46' ' ' SER . 6.2 Cg_endo -58.49 -60.02 0.42 Allowed 'Trans proline' 0 C--N 1.366 1.491 0 C-N-CA 121.847 1.698 . . . . 0.0 111.545 -179.044 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 50.8 m 63.28 175.97 0.16 Allowed 'General case' 0 C--N 1.345 0.408 0 C-N-CA 123.308 0.643 . . . . 0.0 110.512 -178.846 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -66.46 -36.66 83.33 Favored 'General case' 0 N--CA 1.455 -0.189 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 178.513 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 14.7 p -154.4 149.72 12.41 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.412 0 N-CA-C 108.696 -0.853 . . . . 0.0 108.696 179.138 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -148.68 -142.78 0.13 Allowed 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 109.009 -0.737 . . . . 0.0 109.009 -179.824 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 32.6 ptt-85 -165.46 -46.53 0.03 OUTLIER 'General case' 0 CA--C 1.529 0.173 0 N-CA-C 109.759 -0.46 . . . . 0.0 109.759 -179.826 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 12.3 p -174.01 -68.38 0.01 OUTLIER 'General case' 0 N--CA 1.455 -0.211 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 -179.902 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 64.19 -175.98 0.16 Allowed 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 122.885 0.474 . . . . 0.0 109.784 -179.476 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -162.74 162.5 26.76 Favored 'General case' 0 N--CA 1.456 -0.155 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 -179.667 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 58.0 t . . . . . 0 C--O 1.252 1.199 0 CA-C-O 116.133 -1.889 . . . . 0.0 108.914 178.885 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 51.3 ttp . . . . . 0 N--CA 1.471 0.614 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -70.72 176.36 4.26 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 110.069 -0.345 . . . . 0.0 110.069 -179.918 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.3 m -158.69 -46.92 0.06 Allowed 'General case' 0 C--O 1.224 -0.259 0 N-CA-C 109.861 -0.422 . . . . 0.0 109.861 -178.848 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.47 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 11.4 tt 159.07 -37.03 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 C-N-CA 125.173 1.389 . . . . 0.0 108.26 -179.323 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 67.0 mttm -61.11 -62.71 1.65 Allowed 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 123.428 0.691 . . . . 0.0 110.956 -178.114 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -51.94 -48.45 64.27 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.315 -178.98 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 10.9 t -65.01 -38.63 83.29 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.363 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.73 -177.705 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.25 -38.76 90.5 Favored 'General case' 0 CA--C 1.531 0.213 0 N-CA-C 110.414 -0.217 . . . . 0.0 110.414 -179.627 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 64.8 mmtt -73.47 -35.52 65.72 Favored 'General case' 0 CA--C 1.53 0.19 0 N-CA-C 110.121 -0.326 . . . . 0.0 110.121 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.59 -40.41 80.48 Favored 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 178.145 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -70.54 -48.55 54.9 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 123.024 0.53 . . . . 0.0 111.096 -178.585 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 4.6 t-20 -156.28 -137.16 0.06 Allowed 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 110.494 -0.187 . . . . 0.0 110.494 -178.017 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 87.4 t -92.5 -43.01 13.68 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.141 0 C-N-CA 122.873 0.469 . . . . 0.0 110.38 -177.668 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 27.0 t -152.46 167.44 28.75 Favored 'General case' 0 N--CA 1.453 -0.325 0 N-CA-C 110.068 -0.345 . . . . 0.0 110.068 -178.83 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 14.8 t -60.84 -27.75 68.31 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.201 -179.877 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 6.3 m -53.3 -54.14 40.71 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 122.555 0.342 . . . . 0.0 110.223 179.936 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 7.2 m -61.21 -45.45 94.51 Favored 'General case' 0 C--N 1.34 0.177 0 N-CA-C 110.25 -0.278 . . . . 0.0 110.25 -179.321 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 93.4 t -59.4 -38.1 73.18 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.231 0 N-CA-C 109.884 -0.413 . . . . 0.0 109.884 -179.7 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 21.0 t -65.87 -48.31 72.0 Favored 'General case' 0 N--CA 1.449 -0.495 0 N-CA-C 109.314 -0.625 . . . . 0.0 109.314 -179.611 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 59.4 m-70 -52.84 -47.27 67.84 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 110.572 -0.158 . . . . 0.0 110.572 -179.439 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 47.2 t -53.18 -49.95 48.82 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 N-CA-C 109.797 -0.446 . . . . 0.0 109.797 179.767 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 58.1 mt -64.63 -39.07 84.36 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 N-CA-C 110.1 -0.333 . . . . 0.0 110.1 -179.62 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 13.2 m120 -77.51 -4.99 48.44 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 122.22 0.208 . . . . 0.0 110.869 -179.476 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 93.4 mttt 57.33 49.95 12.32 Favored 'General case' 0 C--N 1.344 0.365 0 C-N-CA 122.917 0.487 . . . . 0.0 110.071 -179.701 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 1.1 p -109.63 -79.98 0.58 Allowed 'General case' 0 C--N 1.343 0.285 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 179.752 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 51.2 ttm-85 -72.1 96.6 1.79 Allowed 'General case' 0 N--CA 1.453 -0.294 0 N-CA-C 109.168 -0.678 . . . . 0.0 109.168 179.843 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 32.7 t80 -74.91 98.32 3.53 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 109.866 -0.42 . . . . 0.0 109.866 -179.157 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -85.15 177.55 0.59 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.373 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 178.712 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.5 159.38 29.78 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 178.326 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -57.25 -35.37 69.64 Favored 'General case' 0 N--CA 1.455 -0.214 0 N-CA-C 109.935 -0.394 . . . . 0.0 109.935 179.676 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 51.6 mt-10 -58.89 -51.57 69.46 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 122.355 0.262 . . . . 0.0 110.324 179.876 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.56 -43.02 81.66 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 110.067 -0.346 . . . . 0.0 110.067 -178.748 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 29.7 ttm105 -56.42 -51.25 69.07 Favored 'General case' 0 N--CA 1.454 -0.271 0 N-CA-C 110.055 -0.35 . . . . 0.0 110.055 179.902 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 88.7 m-20 -63.11 -45.3 92.66 Favored 'General case' 0 N--CA 1.456 -0.161 0 N-CA-C 110.09 -0.337 . . . . 0.0 110.09 -179.88 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -56.88 -41.87 78.81 Favored 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 110.509 -0.182 . . . . 0.0 110.509 -179.612 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 36.8 t -64.07 -54.58 29.71 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 N-CA-C 109.947 -0.39 . . . . 0.0 109.947 -179.676 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 29.6 m95 -56.91 -39.89 75.26 Favored 'General case' 0 C--N 1.34 0.19 0 N-CA-C 110.466 -0.198 . . . . 0.0 110.466 -179.316 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -65.03 -56.71 11.52 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 179.622 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -50.09 -45.15 52.41 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 123.062 0.545 . . . . 0.0 111.33 -179.001 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 26.0 mt -53.29 -44.2 53.01 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.233 0 C-N-CA 122.297 0.239 . . . . 0.0 110.703 -178.882 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 39.1 ttpt -81.05 -37.35 29.19 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 122.068 0.147 . . . . 0.0 110.61 -177.557 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 70.0 mt-10 -52.19 -58.33 6.93 Favored 'General case' 0 C--N 1.342 0.259 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 -179.083 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -75.92 -46.67 28.77 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 -179.665 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 69.43 130.98 0.03 OUTLIER 'General case' 0 C--N 1.347 0.48 0 C-N-CA 123.22 0.608 . . . . 0.0 109.718 -178.988 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.47 ' CE2' ' HA ' ' A' ' 4' ' ' ILE . 5.1 p90 -156.77 -139.1 0.07 Allowed 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 179.398 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 5.5 t -45.49 -45.81 33.58 Favored Pre-proline 0 CA--C 1.549 0.913 0 N-CA-C 113.505 0.928 . . . . 0.0 113.505 -177.195 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 4.0 Cg_exo -61.95 131.57 35.59 Favored 'Trans proline' 0 C--N 1.36 1.165 0 C-N-CA 121.375 1.383 . . . . 0.0 110.633 -178.95 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 10.9 m 63.62 23.44 13.56 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 123.155 0.582 . . . . 0.0 111.231 179.641 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -79.95 -17.91 51.79 Favored 'General case' 0 C--N 1.342 0.258 0 N-CA-C 110.119 -0.326 . . . . 0.0 110.119 178.499 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 22.0 t -74.61 78.04 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.286 0 N-CA-C 109.449 -0.575 . . . . 0.0 109.449 -179.578 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -159.52 -141.19 0.08 Allowed 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 108.577 -0.897 . . . . 0.0 108.577 179.556 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 51.8 mmm-85 -123.14 -63.69 1.23 Allowed 'General case' 0 C--N 1.339 0.113 0 N-CA-C 108.991 -0.744 . . . . 0.0 108.991 179.354 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 27.7 t -169.97 -63.14 0.02 OUTLIER 'General case' 0 N--CA 1.457 -0.121 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 179.574 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 60.26 33.33 20.96 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 -179.116 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 25.9 tptp -158.36 144.31 17.0 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 -179.787 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 27.6 m . . . . . 0 C--O 1.248 0.993 0 CA-C-O 116.955 -1.498 . . . . 0.0 109.144 179.044 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.475 0.801 0 CA-C-O 120.721 0.296 . . . . 0.0 110.318 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -161.71 -73.34 0.06 Allowed 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 109.195 -0.668 . . . . 0.0 109.195 -179.487 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . 0.411 ' C ' ' H ' ' A' ' 5' ' ' LYS . 1.6 p 65.64 131.94 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 124.396 1.078 . . . . 0.0 111.311 178.136 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER 74.58 -35.32 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 C-N-CA 124.348 1.059 . . . . 0.0 110.253 179.026 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.411 ' H ' ' C ' ' A' ' 3' ' ' THR . 96.5 mttt -70.78 -59.36 2.85 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 123.075 0.55 . . . . 0.0 110.39 -178.552 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -45.37 -58.56 3.23 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.721 0.808 . . . . 0.0 111.314 -178.422 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 88.3 t -61.44 -47.1 94.99 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.151 0 C-N-CA 122.57 0.348 . . . . 0.0 110.794 -177.15 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -56.74 -44.47 81.73 Favored 'General case' 0 N--CA 1.455 -0.205 0 O-C-N 122.24 -0.288 . . . . 0.0 110.299 -179.548 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.429 ' C ' ' H ' ' A' ' 12' ' ' ASN . 53.0 mttp -72.4 -15.61 61.84 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-O 119.187 -0.435 . . . . 0.0 111.441 -177.887 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 8.6 tpm_? -59.3 -43.87 92.57 Favored 'General case' 0 C--N 1.343 0.297 0 N-CA-C 108.034 -1.098 . . . . 0.0 108.034 177.091 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -99.15 7.08 46.15 Favored 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 176.298 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . 0.429 ' H ' ' C ' ' A' ' 9' ' ' LYS . 47.5 t30 70.74 -84.9 0.03 OUTLIER 'General case' 0 C--N 1.347 0.497 0 C-N-CA 124.519 1.127 . . . . 0.0 110.163 -179.442 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 2.7 t 29.44 -125.2 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.74 0 C-N-CA 124.518 1.127 . . . . 0.0 110.564 -177.845 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.413 ' C ' ' H ' ' A' ' 16' ' ' THR . 1.5 m -175.25 84.52 0.03 OUTLIER 'General case' 0 C--N 1.347 0.487 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 179.084 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.4 p 50.7 -2.5 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 125.252 1.421 . . . . 0.0 114.697 177.591 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.413 ' H ' ' C ' ' A' ' 14' ' ' SER . 0.8 OUTLIER -88.68 -42.47 11.96 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 118.54 0.609 . . . . 0.0 110.669 -177.947 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 13.2 t -51.41 -42.25 61.33 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 122.334 0.253 . . . . 0.0 111.361 -177.908 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 42.4 t -60.12 -54.82 29.5 Favored 'Isoleucine or valine' 0 C--O 1.232 0.134 0 N-CA-C 109.93 -0.396 . . . . 0.0 109.93 -179.076 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 19.7 m -60.0 -42.02 93.38 Favored 'General case' 0 C--O 1.222 -0.361 0 CA-C-N 116.67 -0.241 . . . . 0.0 110.613 -179.496 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 24.3 m170 -62.58 -43.92 97.61 Favored 'General case' 0 CA--C 1.528 0.123 0 C-N-CA 122.202 0.201 . . . . 0.0 110.579 -178.455 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 9.3 t -64.56 -49.61 79.74 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.187 0 C-N-CA 122.249 0.22 . . . . 0.0 110.613 -178.616 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 89.1 mt -65.9 -51.5 60.38 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.23 0 N-CA-C 110.044 -0.354 . . . . 0.0 110.044 -178.669 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 20.4 t-20 -63.88 -31.47 72.67 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 122.649 0.38 . . . . 0.0 111.016 -178.693 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 17.7 ttmt 67.13 40.34 2.88 Favored 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 -177.822 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 12.5 t -74.68 -29.48 61.24 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.331 -179.015 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 2.0 tmt_? -157.96 125.02 5.01 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 -179.423 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 46.4 p90 -59.08 147.87 33.24 Favored 'General case' 0 N--CA 1.454 -0.232 0 N-CA-C 110.026 -0.361 . . . . 0.0 110.026 -179.878 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -106.66 -173.05 0.42 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.327 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 -179.877 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -79.18 40.93 0.43 Allowed 'General case' 0 CA--C 1.536 0.44 0 O-C-N 122.353 -0.217 . . . . 0.0 111.493 -178.06 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 63.95 -74.58 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 123.347 0.659 . . . . 0.0 111.607 178.238 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -58.88 -35.06 72.38 Favored 'General case' 0 C--N 1.341 0.207 0 C-N-CA 122.5 0.32 . . . . 0.0 110.776 -177.946 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 8.9 m -61.06 -40.65 94.47 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 179.205 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 19.5 ttt180 -71.03 -43.03 68.7 Favored 'General case' 0 N--CA 1.454 -0.235 0 N-CA-C 109.689 -0.486 . . . . 0.0 109.689 179.383 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 35.0 t30 -58.07 -45.02 87.81 Favored 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 109.857 -0.423 . . . . 0.0 109.857 179.217 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -58.26 -42.58 86.77 Favored 'General case' 0 N--CA 1.456 -0.174 0 C-N-CA 122.541 0.337 . . . . 0.0 110.667 -179.505 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 25.6 t -62.67 -53.52 45.95 Favored 'Isoleucine or valine' 0 C--O 1.233 0.225 0 N-CA-C 109.924 -0.398 . . . . 0.0 109.924 -179.737 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 38.8 m95 -59.11 -39.97 83.94 Favored 'General case' 0 C--N 1.339 0.144 0 N-CA-C 110.487 -0.19 . . . . 0.0 110.487 -179.828 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -63.76 -52.32 60.94 Favored 'General case' 0 C--O 1.222 -0.369 0 N-CA-C 110.175 -0.306 . . . . 0.0 110.175 -179.459 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -56.07 -39.77 72.57 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 122.386 0.274 . . . . 0.0 111.334 -178.378 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 19.8 mt -53.34 -56.56 7.75 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 C-N-CA 122.219 0.208 . . . . 0.0 111.399 -177.617 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.3 -26.56 24.86 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 117.688 0.222 . . . . 0.0 111.473 -176.536 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -71.23 -47.71 55.65 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 117.875 0.307 . . . . 0.0 110.544 -178.195 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 79.1 mt -80.08 -14.59 58.4 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-O 119.389 -0.339 . . . . 0.0 110.939 -178.38 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 88.0 m-70 53.35 45.5 28.29 Favored 'General case' 0 C--N 1.348 0.514 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 -178.989 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -71.67 29.54 0.05 OUTLIER 'General case' 0 CA--C 1.547 0.827 0 CA-C-N 115.76 -0.655 . . . . 0.0 112.673 -177.295 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 49.2 p 42.75 79.0 0.35 Allowed Pre-proline 0 C--N 1.348 0.522 0 C-N-CA 123.573 0.749 . . . . 0.0 111.528 178.711 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_exo -60.45 149.84 84.23 Favored 'Trans proline' 0 N--CA 1.449 -1.142 0 C-N-CA 122.529 2.152 . . . . 0.0 110.155 178.75 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 16.0 m -54.56 -55.67 26.89 Favored 'General case' 0 C--N 1.34 0.161 0 N-CA-C 110.259 -0.274 . . . . 0.0 110.259 -179.638 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . 58.41 -91.26 0.03 OUTLIER 'General case' 0 C--N 1.346 0.426 0 C-N-CA 123.203 0.601 . . . . 0.0 110.598 179.946 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 7.1 p -68.99 149.7 11.04 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 -179.654 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -161.39 -47.74 0.04 OUTLIER 'General case' 0 C--N 1.341 0.224 0 N-CA-C 110.125 -0.324 . . . . 0.0 110.125 -179.5 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 93.3 mtt-85 -64.21 -45.37 88.6 Favored 'General case' 0 C--N 1.34 0.186 0 N-CA-C 110.148 -0.316 . . . . 0.0 110.148 -179.445 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 10.0 m -67.49 167.99 11.75 Favored 'General case' 0 C--O 1.234 0.237 0 N-CA-C 109.98 -0.378 . . . . 0.0 109.98 179.815 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 87.8 mt -75.32 72.85 2.39 Favored 'General case' 0 CA--C 1.529 0.169 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 179.578 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 29.0 mmtp 56.34 -111.69 0.64 Allowed 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 -179.399 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.449 HG22 ' O ' ' A' ' 56' ' ' VAL . 9.9 p . . . . . 0 C--O 1.25 1.085 0 CA-C-O 116.769 -1.586 . . . . 0.0 110.467 -179.802 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 64.8 mtt . . . . . 0 N--CA 1.472 0.644 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 55.84 32.1 18.96 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 122.688 0.395 . . . . 0.0 110.809 -179.824 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 2.0 m -148.6 -56.51 0.21 Allowed 'General case' 0 C--N 1.343 0.287 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 178.33 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 19.6 tt -55.71 -37.9 48.6 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.444 0 N-CA-C 109.937 -0.394 . . . . 0.0 109.937 179.052 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -60.24 -64.15 1.05 Allowed 'General case' 0 N--CA 1.441 -0.91 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.295 -177.887 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -61.27 -52.82 63.15 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 122.963 0.505 . . . . 0.0 111.368 -178.177 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 86.2 t -59.36 -42.59 87.91 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.291 0 CA-C-O 119.517 -0.278 . . . . 0.0 111.272 -176.583 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -54.93 -53.71 52.05 Favored 'General case' 0 C--N 1.341 0.23 0 CA-C-N 118.014 0.37 . . . . 0.0 110.151 -179.128 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 20.1 mmmt -60.68 -47.92 84.12 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 110.006 -0.368 . . . . 0.0 110.006 -178.509 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.49 -37.16 77.52 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 116.455 -0.338 . . . . 0.0 110.624 -178.903 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -73.58 -47.84 37.45 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 122.089 0.156 . . . . 0.0 110.649 -178.489 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 50.1 t30 -171.25 139.78 1.38 Allowed 'General case' 0 C--N 1.347 0.485 0 N-CA-C 110.204 -0.295 . . . . 0.0 110.204 -177.562 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER 23.32 -87.3 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.954 0 C-N-CA 125.162 1.385 . . . . 0.0 112.811 177.636 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 71.8 m -151.18 -172.07 4.11 Favored 'General case' 0 C--N 1.348 0.518 0 C-N-CA 122.647 0.379 . . . . 0.0 110.074 -179.32 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 21.3 p -55.31 -16.19 3.19 Favored 'General case' 0 C--N 1.345 0.401 0 C-N-CA 123.253 0.621 . . . . 0.0 111.518 -179.053 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 4.7 m -52.41 -39.97 61.58 Favored 'General case' 0 CA--C 1.534 0.362 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 177.118 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 75.4 m -69.68 -40.17 76.54 Favored 'General case' 0 C--N 1.342 0.261 0 N-CA-C 109.95 -0.389 . . . . 0.0 109.95 179.054 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 84.0 t -59.46 -37.85 72.03 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.21 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 179.858 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 15.7 m -56.06 -39.12 71.55 Favored 'General case' 0 C--N 1.341 0.196 0 N-CA-C 110.067 -0.346 . . . . 0.0 110.067 179.146 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 23.8 m170 -62.57 -29.71 70.79 Favored 'General case' 0 C--O 1.223 -0.307 0 N-CA-C 110.155 -0.313 . . . . 0.0 110.155 179.991 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.594 HG22 ' HD2' ' A' ' 33' ' ' ARG . 5.1 t -80.42 -49.37 18.82 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.141 0 C-N-CA 122.202 0.201 . . . . 0.0 110.912 -177.97 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 78.9 mt -44.81 -53.99 1.35 Allowed 'Isoleucine or valine' 0 C--N 1.341 0.238 0 C-N-CA 122.811 0.444 . . . . 0.0 111.455 -175.675 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.7 p-10 -114.43 26.74 10.0 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-O 119.861 -0.114 . . . . 0.0 110.923 -177.852 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 74.1 tttt 40.61 51.68 3.01 Favored 'General case' 0 C--N 1.346 0.437 0 C-N-CA 123.009 0.524 . . . . 0.0 110.68 179.62 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -67.12 -31.81 72.52 Favored 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 -179.811 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 59.2 ttt85 -158.1 111.86 2.49 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 179.658 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 48.8 p90 -78.53 136.71 37.63 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 109.205 -0.665 . . . . 0.0 109.205 179.425 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 57.3 t -112.44 83.74 0.69 Allowed 'Isoleucine or valine' 0 N--CA 1.457 -0.121 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 179.703 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . 59.44 13.4 3.21 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 115.683 -0.689 . . . . 0.0 111.535 -179.335 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 71.17 -55.93 0.64 Allowed 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 123.912 0.885 . . . . 0.0 111.538 179.431 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -45.14 -46.92 12.22 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.355 0.662 . . . . 0.0 111.853 -177.805 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 32.1 m -58.86 -39.88 82.66 Favored 'General case' 0 N--CA 1.455 -0.207 0 O-C-N 122.226 -0.296 . . . . 0.0 110.266 -178.512 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.594 ' HD2' HG22 ' A' ' 21' ' ' VAL . 20.2 mmt180 -70.42 -40.47 73.8 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 -178.977 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 13.4 m-80 -61.9 -39.73 93.02 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 178.208 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -61.21 -52.17 65.9 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 109.959 -0.386 . . . . 0.0 109.959 179.468 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 53.4 t -55.17 -50.69 62.01 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 N-CA-C 110.116 -0.327 . . . . 0.0 110.116 178.844 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 10.5 m95 -58.59 -40.71 83.99 Favored 'General case' 0 C--N 1.341 0.224 0 N-CA-C 110.368 -0.234 . . . . 0.0 110.368 -179.73 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -62.61 -49.77 73.89 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 179.473 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -56.07 -41.87 75.79 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 122.42 0.288 . . . . 0.0 110.421 179.936 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.406 ' HA ' ' CE1' ' A' ' 45' ' ' TYR . 37.3 mt -61.71 -34.47 62.37 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 N-CA-C 110.461 -0.2 . . . . 0.0 110.461 -179.805 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 4.1 ttpm? -83.0 -36.58 24.91 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 122.362 0.265 . . . . 0.0 110.708 -177.3 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -77.54 -47.79 18.63 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 122.191 0.196 . . . . 0.0 111.502 -177.076 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 79.0 mt -76.98 -29.6 55.6 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-O 119.74 -0.172 . . . . 0.0 110.842 -177.897 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 6.3 m-70 73.78 121.98 0.04 OUTLIER 'General case' 0 C--N 1.344 0.362 0 C-N-CA 123.27 0.628 . . . . 0.0 109.632 -178.612 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.406 ' CE1' ' HA ' ' A' ' 40' ' ' ILE . 3.4 m-85 -105.67 -179.85 4.06 Favored 'General case' 0 N--CA 1.463 0.185 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 -179.724 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 8.3 p -154.8 69.23 5.73 Favored Pre-proline 0 CA--C 1.537 0.455 0 N-CA-C 109.034 -0.728 . . . . 0.0 109.034 176.814 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 7.6 Cg_endo -71.32 85.53 0.86 Allowed 'Trans proline' 0 N--CA 1.448 -1.151 0 C-N-CA 122.748 2.298 . . . . 0.0 110.271 -178.417 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 15.2 t 54.75 31.05 14.68 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 122.821 0.448 . . . . 0.0 110.435 -179.875 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -167.15 167.94 13.94 Favored 'General case' 0 N--CA 1.453 -0.28 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 -179.526 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 11.0 p -153.71 145.65 14.42 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.262 0 N-CA-C 109.141 -0.688 . . . . 0.0 109.141 179.612 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -70.17 -61.23 1.86 Allowed 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 109.708 -0.479 . . . . 0.0 109.708 -179.764 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 72.9 ttt-85 -160.04 78.74 0.68 Allowed 'General case' 0 N--CA 1.455 -0.209 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 179.802 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 70.2 m 55.86 -96.84 0.07 Allowed 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 122.727 0.411 . . . . 0.0 110.324 179.771 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -162.32 167.79 23.28 Favored 'General case' 0 N--CA 1.456 -0.174 0 N-CA-C 109.438 -0.579 . . . . 0.0 109.438 179.953 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 20.6 ttpp 75.42 -60.55 0.5 Allowed 'General case' 0 C--N 1.344 0.369 0 C-N-CA 123.672 0.789 . . . . 0.0 110.566 179.898 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 8.1 p . . . . . 0 C--O 1.253 1.246 0 CA-C-O 117.193 -1.384 . . . . 0.0 109.469 -179.611 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.5 ppp? . . . . . 0 N--CA 1.473 0.719 0 N-CA-C 110.12 -0.326 . . . . 0.0 110.12 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 62.21 178.09 0.13 Allowed 'General case' 0 C--N 1.347 0.479 0 C-N-CA 123.166 0.586 . . . . 0.0 110.524 -179.418 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . 0.434 ' N ' ' CE2' ' A' ' 45' ' ' TYR . 0.4 OUTLIER 78.58 -29.04 0.15 Allowed 'General case' 0 C--N 1.35 0.597 0 C-N-CA 123.425 0.69 . . . . 0.0 110.713 178.11 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 7.1 mt -125.41 -38.85 1.01 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.54 0 C-N-CA 122.656 0.383 . . . . 0.0 110.819 -178.492 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 20.8 ttpp -49.67 -55.75 12.65 Favored 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 111.879 0.325 . . . . 0.0 111.879 -176.754 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 -79.86 -42.28 24.58 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 118.247 0.476 . . . . 0.0 110.553 -176.652 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 28.6 t -57.33 -35.03 47.62 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.36 0 C-N-CA 122.442 0.297 . . . . 0.0 110.586 -180.0 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -52.93 -66.09 0.44 Allowed 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 123.224 0.609 . . . . 0.0 111.042 -178.59 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.95 -35.79 72.33 Favored 'General case' 0 C--N 1.334 -0.107 0 CA-C-O 119.592 -0.242 . . . . 0.0 110.435 -178.971 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 12.5 tpt180 -55.26 -40.35 70.86 Favored 'General case' 0 C--N 1.341 0.206 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 178.743 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -68.78 -62.75 1.25 Allowed 'General case' 0 N--CA 1.448 -0.558 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 177.615 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -177.58 -88.24 0.0 OUTLIER 'General case' 0 C--N 1.351 0.667 0 N-CA-C 112.066 0.395 . . . . 0.0 112.066 178.585 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 55.7 t -69.23 -86.38 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.343 0.291 0 C-N-CA 122.476 0.31 . . . . 0.0 111.205 -174.473 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 9.0 t -158.48 -157.94 0.67 Allowed 'General case' 0 N--CA 1.45 -0.437 0 N-CA-C 110.173 -0.306 . . . . 0.0 110.173 -177.421 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 38.0 p -55.82 -30.17 60.95 Favored 'General case' 0 C--N 1.341 0.221 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.188 -179.532 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 16.6 p -49.94 -44.51 50.5 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 122.756 0.422 . . . . 0.0 110.219 179.127 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 21.3 m -53.24 -36.26 60.88 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 122.43 0.292 . . . . 0.0 110.477 -179.686 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 25.8 t -80.86 -44.26 21.18 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.294 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 179.627 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 14.8 m -55.21 -32.23 62.08 Favored 'General case' 0 C--N 1.344 0.357 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 -179.427 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 62.4 m170 -54.83 -64.72 0.74 Allowed 'General case' 0 N--CA 1.445 -0.696 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.157 179.356 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 15.7 t -62.36 -27.82 43.43 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.246 0 C-N-CA 120.997 -0.281 . . . . 0.0 111.396 -176.495 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 6.1 mm -65.69 -51.68 59.47 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.518 0 CA-C-N 117.872 0.306 . . . . 0.0 110.826 -178.818 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -167.6 31.53 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 117.937 0.335 . . . . 0.0 111.556 -177.595 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 26.6 tptt -158.74 40.11 0.23 Allowed 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 120.69 -0.404 . . . . 0.0 110.624 -179.59 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 10.0 t -79.68 -31.02 41.3 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.664 -176.228 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 56.8 mtm180 57.36 -158.94 0.26 Allowed 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 109.549 -0.537 . . . . 0.0 109.549 179.962 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -80.4 99.17 7.83 Favored 'General case' 0 N--CA 1.453 -0.278 0 O-C-N 122.151 -0.343 . . . . 0.0 110.717 -178.006 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.0 m -143.69 161.55 16.26 Favored 'Isoleucine or valine' 0 C--O 1.233 0.221 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 175.955 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -74.0 170.17 15.98 Favored 'General case' 0 N--CA 1.446 -0.625 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 179.559 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 47.6 mm-40 -64.65 -18.01 64.56 Favored 'General case' 0 C--O 1.223 -0.306 0 N-CA-C 110.178 -0.304 . . . . 0.0 110.178 178.64 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -48.74 -55.14 12.3 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 122.943 0.497 . . . . 0.0 110.92 179.922 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 4.6 p -65.36 -41.22 94.07 Favored 'General case' 0 CA--C 1.531 0.243 0 O-C-N 122.378 -0.201 . . . . 0.0 111.045 -178.153 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 74.6 mtt85 -63.76 -53.66 47.56 Favored 'General case' 0 C--O 1.232 0.175 0 N-CA-C 111.375 0.139 . . . . 0.0 111.375 -177.205 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -69.36 -36.33 76.75 Favored 'General case' 0 C--O 1.223 -0.305 0 CA-C-O 119.677 -0.201 . . . . 0.0 110.732 -176.602 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -58.48 -50.69 72.83 Favored 'General case' 0 C--N 1.342 0.244 0 CA-C-N 117.843 0.292 . . . . 0.0 110.68 -178.99 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 48.7 t -58.06 -58.36 6.71 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.277 0 N-CA-C 110.559 -0.163 . . . . 0.0 110.559 -178.639 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 15.0 m95 -59.3 -40.26 85.65 Favored 'General case' 0 C--N 1.341 0.213 0 N-CA-C 110.747 -0.094 . . . . 0.0 110.747 -178.244 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -59.88 -50.8 72.35 Favored 'General case' 0 C--O 1.22 -0.455 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 -179.458 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -60.25 -47.74 84.71 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 122.026 0.131 . . . . 0.0 110.694 -179.199 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 58.5 mt -55.76 -47.41 79.41 Favored 'Isoleucine or valine' 0 C--N 1.341 0.2 0 C-N-CA 122.324 0.25 . . . . 0.0 111.105 -178.386 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -77.33 -41.14 41.67 Favored 'General case' 0 N--CA 1.448 -0.545 0 N-CA-C 110.372 -0.233 . . . . 0.0 110.372 -176.235 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -57.09 -48.46 78.56 Favored 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 110.161 -0.311 . . . . 0.0 110.161 -178.489 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 55.4 mt -83.7 -20.7 33.01 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.022 -178.458 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 91.4 m-70 55.89 26.53 9.85 Favored 'General case' 0 C--N 1.351 0.632 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 -176.956 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.434 ' CE2' ' N ' ' A' ' 3' ' ' THR . 16.6 t80 52.1 82.78 0.06 Allowed 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 123.319 0.648 . . . . 0.0 109.772 -175.541 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 22.8 t -109.98 104.1 54.86 Favored Pre-proline 0 CA--C 1.537 0.442 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 -179.866 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -69.79 176.19 7.12 Favored 'Trans proline' 0 N--CA 1.45 -1.048 0 C-N-CA 122.533 2.155 . . . . 0.0 110.536 179.902 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 15.0 m -54.51 -34.92 62.56 Favored 'General case' 0 C--N 1.342 0.257 0 CA-C-N 116.383 -0.372 . . . . 0.0 110.675 179.76 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -79.52 62.56 3.86 Favored 'General case' 0 C--N 1.342 0.272 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 179.772 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 59.4 t -60.31 -35.45 62.41 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 N-CA-C 109.88 -0.415 . . . . 0.0 109.88 -179.907 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -63.18 -25.4 68.33 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 122.44 0.296 . . . . 0.0 110.88 -179.721 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 72.3 mtp85 54.22 53.78 10.5 Favored 'General case' 0 C--N 1.346 0.454 0 N-CA-C 109.765 -0.458 . . . . 0.0 109.765 -179.074 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 27.6 m -148.41 36.86 0.82 Allowed 'General case' 0 CA--C 1.529 0.147 0 N-CA-C 109.914 -0.402 . . . . 0.0 109.914 179.678 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 3.0 mp -128.27 140.3 51.96 Favored 'General case' 0 C--N 1.341 0.235 0 N-CA-C 108.936 -0.764 . . . . 0.0 108.936 179.655 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 66.2 mttp -81.41 137.72 35.65 Favored 'General case' 0 N--CA 1.455 -0.199 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 179.939 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 58.3 t . . . . . 0 C--O 1.248 1.021 0 CA-C-O 116.945 -1.502 . . . . 0.0 108.863 179.932 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 57.9 ttm . . . . . 0 N--CA 1.475 0.78 0 N-CA-C 109.967 -0.382 . . . . 0.0 109.967 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -162.77 -88.26 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 179.808 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . 0.564 HG22 ' H ' ' A' ' 4' ' ' ILE . 2.4 m 77.78 178.95 0.14 Allowed 'General case' 0 C--N 1.344 0.358 0 N-CA-C 108.384 -0.969 . . . . 0.0 108.384 178.698 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.564 ' H ' HG22 ' A' ' 3' ' ' THR . 1.0 OUTLIER -41.48 -36.57 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.347 0.468 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 179.004 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 26.2 mmtp -46.53 -62.07 1.53 Allowed 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 122.837 0.455 . . . . 0.0 111.187 179.043 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 30.1 m-20 -91.17 -32.46 15.8 Favored 'General case' 0 C--N 1.347 0.468 0 CA-C-N 117.909 0.322 . . . . 0.0 111.425 -176.337 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 70.4 t -58.12 -42.97 84.46 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 179.222 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.94 -42.64 97.27 Favored 'General case' 0 C--O 1.22 -0.451 0 N-CA-C 110.372 -0.233 . . . . 0.0 110.372 179.823 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 41.3 mtpt -61.34 -47.51 85.57 Favored 'General case' 0 C--N 1.338 0.108 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 179.627 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -55.19 -39.89 70.09 Favored 'General case' 0 N--CA 1.454 -0.233 0 N-CA-C 109.492 -0.559 . . . . 0.0 109.492 179.602 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -70.31 -56.55 6.45 Favored 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 110.368 -0.234 . . . . 0.0 110.368 179.847 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 45.2 t30 -170.91 126.34 0.7 Allowed 'General case' 0 C--N 1.347 0.487 0 CA-C-N 117.387 0.085 . . . . 0.0 111.194 -177.743 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 51.3 t 51.68 -91.31 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.539 0 C-N-CA 123.895 0.878 . . . . 0.0 111.809 176.419 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 28.3 m -157.44 -169.93 3.06 Favored 'General case' 0 C--N 1.346 0.417 0 N-CA-C 109.785 -0.45 . . . . 0.0 109.785 -177.591 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 80.4 p -49.87 -26.7 4.3 Favored 'General case' 0 C--N 1.347 0.496 0 C-N-CA 123.212 0.605 . . . . 0.0 111.104 -179.771 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 18.6 p -50.25 -44.19 53.42 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 122.396 0.279 . . . . 0.0 110.289 179.063 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.3 t -59.88 -37.63 79.89 Favored 'General case' 0 CA--C 1.534 0.333 0 N-CA-C 110.563 -0.162 . . . . 0.0 110.563 -178.621 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 64.6 t -68.62 -45.6 81.29 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.246 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 179.821 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 20.2 m -57.16 -45.74 83.35 Favored 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 179.076 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 52.2 m170 -57.66 -46.32 84.38 Favored 'General case' 0 C--N 1.339 0.152 0 C-N-CA 122.353 0.261 . . . . 0.0 110.373 -179.743 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 32.9 t -65.41 -51.93 58.04 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.05 -178.101 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 94.9 mt -59.49 -54.1 39.14 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.217 0 N-CA-C 110.377 -0.231 . . . . 0.0 110.377 -177.912 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 43.5 m-80 -70.61 -18.98 62.88 Favored 'General case' 0 CA--C 1.532 0.288 0 N-CA-C 110.386 -0.227 . . . . 0.0 110.386 -179.007 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 74.2 tttt 61.05 46.14 8.56 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 122.878 0.471 . . . . 0.0 109.928 179.476 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 15.8 p -96.25 -80.18 0.43 Allowed 'General case' 0 C--N 1.341 0.199 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 179.632 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 78.7 ttt180 -78.81 100.76 7.29 Favored 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 108.968 -0.752 . . . . 0.0 108.968 179.15 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 90.8 t80 -62.11 144.13 55.73 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 109.967 -0.383 . . . . 0.0 109.967 -179.995 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 5.4 m -130.67 170.8 18.83 Favored 'Isoleucine or valine' 0 CA--C 1.523 -0.081 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 179.463 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -61.78 158.4 15.85 Favored 'General case' 0 N--CA 1.45 -0.449 0 N-CA-C 109.978 -0.379 . . . . 0.0 109.978 179.796 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 50.7 mm-40 -48.73 -45.01 38.9 Favored 'General case' 0 C--N 1.34 0.178 0 CA-C-N 116.042 -0.526 . . . . 0.0 109.889 179.049 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -52.85 -53.7 45.07 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 122.715 0.406 . . . . 0.0 111.436 -178.146 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 10.0 m -61.15 -51.94 66.96 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 117.804 0.274 . . . . 0.0 110.817 -177.179 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 30.9 ttp180 -58.53 -52.76 64.27 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 122.02 0.128 . . . . 0.0 110.798 -177.931 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 90.5 m-20 -63.34 -40.67 97.94 Favored 'General case' 0 N--CA 1.455 -0.189 0 N-CA-C 110.465 -0.198 . . . . 0.0 110.465 -178.025 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -61.14 -47.85 84.31 Favored 'General case' 0 C--O 1.224 -0.258 0 N-CA-C 110.284 -0.265 . . . . 0.0 110.284 -179.885 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 13.1 t -54.31 -52.41 39.08 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 179.926 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 26.0 m95 -62.85 -38.21 89.9 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 110.059 -0.348 . . . . 0.0 110.059 179.874 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -89.01 28.12 1.24 Allowed 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 122.251 0.22 . . . . 0.0 110.606 179.784 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -131.14 -46.63 1.01 Allowed 'General case' 0 N--CA 1.456 -0.14 0 N-CA-C 108.474 -0.936 . . . . 0.0 108.474 176.76 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 60.7 mt -55.48 -46.77 78.9 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.224 0 N-CA-C 109.839 -0.43 . . . . 0.0 109.839 178.902 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 4.6 ptpp? -107.81 32.93 4.36 Favored 'General case' 0 C--N 1.344 0.365 0 C-N-CA 122.144 0.178 . . . . 0.0 110.634 -178.609 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -138.77 -55.75 0.61 Allowed 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 179.181 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -85.18 13.67 6.06 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 110.048 -0.352 . . . . 0.0 110.048 179.309 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 3.8 t-80 78.39 149.95 0.11 Allowed 'General case' 0 N--CA 1.446 -0.632 0 CA-C-O 121.807 0.813 . . . . 0.0 110.88 177.644 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 26.2 t80 -156.95 147.64 21.56 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 114.336 -1.302 . . . . 0.0 108.812 179.003 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 64.9 m -130.38 93.16 33.43 Favored Pre-proline 0 CA--C 1.533 0.31 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 -179.494 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 1.4 Cg_endo -65.86 170.85 10.76 Favored 'Trans proline' 0 N--CA 1.45 -1.086 0 C-N-CA 122.445 2.097 . . . . 0.0 110.656 179.526 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 12.9 p -75.14 151.15 38.57 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 109.759 -0.46 . . . . 0.0 109.759 179.562 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . 51.81 69.65 0.64 Allowed 'General case' 0 C--N 1.344 0.331 0 C-N-CA 122.863 0.465 . . . . 0.0 110.504 179.616 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.401 HG22 ' H ' ' A' ' 50' ' ' VAL . 3.3 m -70.65 79.75 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 179.6 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . 57.73 29.94 18.16 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 122.993 0.517 . . . . 0.0 110.24 -179.563 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 44.7 mtm105 -147.01 114.65 6.4 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 -179.894 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 17.3 p -60.77 -54.48 44.74 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 109.449 -0.574 . . . . 0.0 109.449 179.488 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 6.2 tp 50.54 -125.57 2.25 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 109.719 -0.475 . . . . 0.0 109.719 179.115 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 83.2 tttt -159.56 124.53 4.05 Favored 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 179.548 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 32.6 m . . . . . 0 C--O 1.251 1.181 0 CA-C-O 116.086 -1.912 . . . . 0.0 110.817 -178.769 . . . . . . . . 0 0 . 1 stop_ save_